forcefield              AMOEBA-2009

bond-cubic              -2.55
bond-quartic            3.793125
angle-cubic             -0.014
angle-quartic           0.000056
angle-pentic            -0.0000007
angle-sextic            0.000000022
opbendtype              ALLINGER
opbend-cubic            -0.014
opbend-quartic          0.000056
opbend-pentic           -0.0000007
opbend-sextic           0.000000022
torsionunit             0.5
vdwtype                 BUFFERED-14-7
radiusrule              CUBIC-MEAN
radiustype              R-MIN
radiussize              DIAMETER
epsilonrule             HHG
dielectric              1.0
polarization            MUTUAL
vdw-12-scale            0.0
vdw-13-scale            0.0
vdw-14-scale            1.0
vdw-15-scale            1.0
mpole-12-scale          0.0
mpole-13-scale          0.0
mpole-14-scale          0.4
mpole-15-scale          0.8
polar-12-scale          0.0
polar-13-scale          0.0
polar-14-scale          1.0
polar-15-scale          1.0
polar-12-intra          0.0
polar-13-intra          0.0
polar-14-intra          0.5
polar-15-intra          1.0
direct-11-scale         0.0
direct-12-scale         1.0
direct-13-scale         1.0
direct-14-scale         1.0
mutual-11-scale         1.0
mutual-12-scale         1.0
mutual-13-scale         1.0
mutual-14-scale         1.0


angle     24     23     24   65.00  109.47
angle     29     28     29   39.57  109.47
angle     30     30     31   42.44  109.80  109.31  110.70
angle     31     30     31   39.57  107.60  107.80  109.47
angle     31     30     32   42.44  109.80  109.31  110.70
angle     31     30     34   42.00  110.70
angle     30     32     30   48.20  109.50  110.20  111.00
angle     30     32     32   48.20  109.50  110.20  111.00
angle     30     32     33   42.44  109.80  109.31  110.70
angle     32     32     32   48.20  109.50  110.20  111.00
angle     32     32     33   42.44  109.80  109.31  110.70
angle     33     32     33   39.57  107.60  107.80  109.47
angle     30     34     30   48.20  109.50  110.20  111.00
angle     30     34     32   48.20  109.50  110.20  111.00
angle     30     34     35   42.00  112.80
angle     32     34     32   48.20  109.50  110.20  111.00
angle     32     34     35   42.00  112.80
angle     38     37     38   48.70  108.50
angle     40     39     41   64.96  106.80
angle     40     39     43   64.96  106.80
angle     40     39     46   53.96  106.80
angle     40     39     92   25.90  109.00
angle     43     39     43   88.50  106.00
angle     39     41     42   60.99  110.00  108.90  108.70
angle     42     41     42   45.57  107.60  107.80  109.47
angle     39     43     42   60.99  110.00  108.90  108.70
angle     39     43     43   65.71  107.50  107.00  107.90
angle     39     43     47   70.00  110.00  108.90  108.70
angle     42     43     42   40.57  107.60  107.80  109.47
angle     42     43     43   45.44  109.80  109.31  110.70
angle     43     43     43   48.20  109.50  110.20  111.00
angle     43     43     44   45.44  109.80  109.31  110.70
angle     43     43     45   45.44  109.80  109.31  110.70
angle     43     43     52   56.11  109.47  108.00  111.00
angle     43     43     54   42.44  109.80  109.31  110.70
angle     43     43     55   42.44  109.80  109.31  110.70
angle     43     43     59   53.96  109.48  111.30  111.80
angle     43     43     62   42.44  109.80  109.31  110.70
angle     43     43     79   53.00  108.00
angle     43     43     81   42.44  109.80  109.30  110.70
angle     43     43     92   38.85  110.60
angle     43     43     95   38.85  112.70
angle     44     43     44   40.57  107.60  107.80  109.47
angle     44     43     46   42.44  109.80  109.31  110.70
angle     44     43     92   39.57  109.50  109.31  110.40
angle     44     43     95   39.57  109.50
angle     45     43     45   45.57  107.60  107.80  109.47
angle     45     43     52   58.99  109.30
angle     47     43     47   43.57  107.60  107.80  109.47
angle     52     43     54   70.99  109.30
angle     52     43     55   58.99  109.30
angle     54     43     54   40.57  107.60  107.80  109.47
angle     54     43     92   39.57  109.50  109.31  110.40
angle     55     43     55   39.57  107.60  107.80  109.47
angle     56     43     61   38.85  109.49
angle     59     43     62   54.67  111.00
angle     61     43     61   39.57  107.60  107.80  109.47
angle     62     43     62   39.57  107.60  107.80  109.47
angle     65     43     67   38.85  109.49
angle     67     43     67   39.57  107.60  107.80  109.47
angle     79     43     81   35.00  108.15
angle     81     43     81   39.00  110.75
angle     39     46     42   58.99  110.00  108.90  108.70
angle     39     46     43   59.71  107.50  107.00  107.90
angle     42     46     43   42.44  109.80  109.31  110.70
angle     43     46     43   48.20  109.50  110.20  111.00
angle     49     48     49   43.52  106.40  106.80    0.00
angle     51     50     51   43.52  109.47
angle     43     52     43   51.80  107.20  108.20    0.00
angle     43     52     53   43.16  108.10  110.90    0.00
angle     53     52     53   34.50  106.40  107.10    0.00
angle     64     63     65   49.64  108.70
angle     69     68     69   52.52   92.90
angle     65     70     65   60.43   95.90
angle     65     70     71   46.76   96.00
angle     65     73     74   42.44  109.80  109.31  110.70
angle     74     73     74   39.57  107.60  107.80  109.47
angle     76     75     77   57.25  106.88
angle     77     75     77   87.39   92.98
angle     75     77     78   44.07  107.06
angle     78     77     78   38.95  110.07
angle     43     79     80   60.00  104.60
angle     80     79     80   70.00  113.50
angle     83     82     84   18.40  180.00
angle     83     82     85   65.00  180.00
angle     82     85     86   45.00  109.92
angle     86     85     86   40.00  109.02
angle     88     87     89   42.00  180.00
angle     49     94     95   35.25  125.50
angle     49     94     97   35.25  125.50
angle     95     94     95   86.33  105.10  107.10    0.00
angle     97     94     97   86.33  109.00
angle     43     95     94   35.97  122.00
angle     43     95     95   35.97  131.00
angle     94     95     94   28.78  112.10
angle     94     95     95   47.48  107.00
angle     94     95     96   38.13  122.50
angle     95     95     96   35.25  128.00
angle     44     98     44   39.57  107.60  107.80  109.47
angle     44     98     97   61.15  109.80  109.31  110.70
angle     44     98     98   42.44  109.80  109.31  110.70
angle     97     98     98   48.20  109.50  110.20  111.00

anglep     43     56     58   80.00  122.40
anglep     43     56     59   70.00  113.40
anglep     57     56     58   68.34  119.20
anglep     57     56     59   31.65  109.30
anglep     58     56     59   76.98  124.20
anglep     66     56     97   33.38  116.10  117.30    0.00
anglep     66     56     99   61.15  119.20  119.20    0.00
anglep     97     56     99   61.15  123.50  123.50    0.00
anglep     43     59     43   54.67  122.50
anglep     43     59     56   50.00  122.00
anglep     43     59     60   32.01  117.00
anglep     56     59     60   50.00  121.00
anglep     60     59     60   22.30  122.00
anglep     43     65     58   61.15  123.50  123.50    0.00
anglep     43     65     63  111.51  110.30
anglep     43     65     66   33.38  116.10  117.30    0.00
anglep     58     65     63  122.30  121.50  122.50    0.00
anglep     58     65     66   61.15  119.20  119.20    0.00
anglep     63     65     66   39.57  107.00
anglep     66     65     66   46.76  115.50
anglep     70     65     72   60.24  110.80  110.80  108.00
anglep     70     65     73   53.24  108.00  109.50  110.10
anglep     72     65     72   39.57  107.60  107.80  109.47
anglep     72     65     73   42.44  109.80  109.31  110.70
anglep     87     89     87   65.00  120.00
anglep     90     90     90   63.31  120.00
anglep     90     90     91   35.25  120.00  120.50    0.00
anglep     90     90    103   69.78  121.00
anglep     91     90    103   38.13  119.00
anglep     39     92     92   43.16  120.00
anglep     43     92     92   33.81  122.30
anglep     92     92     92   64.67  121.70
anglep     92     92     93   35.25  120.00  120.50    0.00
anglep     92     92    102   54.67  121.70
anglep     56     97     97   54.67  121.70
anglep     91     97     94   38.13  122.50
anglep     91     97     97   35.25  128.00
anglep     94     97     97   47.48  109.00
anglep     97     97     97   63.31  120.00
anglep     97     97     98   61.87  127.00
anglep    101    100    101   29.50  123.00
anglep    101    100    102   41.70  120.50
anglep     92    102    100   28.80  120.00
anglep    100    102    100   28.80  120.00
anglep     90    103     90   86.33  112.60
anglep     90    103    104   35.25  123.70

atom      1      1  He    "Helium Atom He"             2    4.0030  0
atom      2      2  Ne    "Neon Atom Ne"              10   20.1790  0
atom      3      3  Ar    "Argon Atom Ar"             18   39.9480  0
atom      4      4  Kr    "Krypton Atom Kr"           36   83.8000  0
atom      5      5  Xe    "Xenon Atom Xe"             54  131.2900  0
atom      6      6  Li+   "Lithium Ion Li+"            3    6.9410  0
atom      7      7  Na+   "Sodium Ion Na+"            11   22.9900  0
atom      8      8  K+    "Potassium Ion K+"          19   39.0980  0
atom      9      9  Rb+   "Rubidium Ion Rb+"          37   85.4680  0
atom     10     10  Cs+   "Cesium Ion Cs+"            55  132.9050  0
atom     11     11  Be2   "Beryllium Ion Be+2"         4    9.0120  0
atom     12     12  Mg2   "Magnesium Ion Mg+2"        12   24.3050  0
atom     13     13  Ca2   "Calcium Ion Ca+2"          20   40.0780  0
atom     14     14  Sr2   "Strontium Ion Sr+2"        38   87.6200  0
atom     15     15  Ba2   "Barium Ion Ba+2"           56  137.3300  0
atom     16     16  Zn2   "Zinc Ion Zn+2"             30   65.3900  0
atom     17     17  F-    "Fluoride Ion F-"            9   18.9980  0
atom     18     18  Cl-   "Chloride Ion Cl-"          17   35.4530  0
atom     19     19  Br-   "Bromide Ion Br-"           35   79.9040  0
atom     20     20  I-    "Iodide Ion I-"             53  126.9040  0
atom     21     21  C     "Cyanide Ion C"              6   12.0110  1
atom     22     22  N     "Cyanide Ion N"              7   14.0070  1
atom     23     23  B     "Tetrafluoroborate B"        5   10.8100  4
atom     24     24  F     "Tetrafluoroborate F"        9   18.9980  1
atom     25     25  P     "Hexafluorophosphate P"     15   30.9740  6
atom     26     26  F     "Hexafluorophosphate F"      9   18.9980  1
atom     27     27  N     "Dinitrogen N2"              7   14.0070  1
atom     28     28  C     "Methane CH4"                6   12.0110  4
atom     29     29  H     "Methane H4C"                1    1.0080  1
atom     30     30  C     "Ethane CH3"                 6   12.0110  4
atom     31     31  H     "Ethane H3C"                 1    1.0080  1
atom     32     30  C     "Alkane CH3-"                6   12.0110  4
atom     33     31  H     "Alkane H3C-"                1    1.0080  1
atom     34     32  C     "Alkane -CH2-"               6   12.0110  4
atom     35     33  H     "Alkane -H2C-"               1    1.0080  1
atom     36     34  C     "Alkane >CH-"                6   12.0110  4
atom     37     35  H     "Alkane -HC<"                1    1.0080  1
atom     38     36  C     "Alkane >C<"                 6   12.0110  4
atom     39     37  O     "Water O"                    8   15.9990  2
atom     40     38  H     "Water H"                    1    1.0080  1
atom     41     39  O     "Methanol O"                 8   15.9990  2
atom     42     40  H     "Methanol HO"                1    1.0080  1
atom     43     41  C     "Methanol CH3"               6   12.0110  4
atom     44     42  H     "Methanol H3C"               1    1.0080  1
atom     45     39  O     "Ethanol O"                  8   15.9990  2
atom     46     40  H     "Ethanol HO"                 1    1.0080  1
atom     47     43  C     "Ethanol CH2"                6   12.0110  4
atom     48     42  H     "Ethanol H2C"                1    1.0080  1
atom     49     43  C     "Ethanol CH3"                6   12.0110  4
atom     50     44  H     "Ethanol H3C"                1    1.0080  1
atom     51     43  C     "Propanol Me-CH2"            6   12.0110  4
atom     52     45  H     "Propanol Me-CH2"            1    1.0080  1
atom     53     43  C     "Propanol CH3"               6   12.0110  4
atom     54     44  H     "Propanol H3C"               1    1.0080  1
atom     55     39  O     "isoPropanol O"              8   15.9990  2
atom     56     40  H     "isoPropanol HO"             1    1.0080  1
atom     57     46  C     "isoPropanol >CH-"           6   12.0110  4
atom     58     42  H     "isoPropanol >CH-"           1    1.0080  1
atom     59     43  C     "isoPropanol CH3"            6   12.0110  4
atom     60     44  H     "isoPropanol H3C"            1    1.0080  1
atom     61     39  O     "Methyl Ether O"             8   15.9990  2
atom     62     43  C     "Methyl Ether CH3"           6   12.0110  4
atom     63     47  H     "Methyl Ether H3C"           1    1.0080  1
atom     64     48  N     "Ammonia N"                  7   14.0070  3
atom     65     49  H     "Ammonia H3N"                1    1.0080  1
atom     66     50  N     "Ammonium Ion N+"            7   14.0070  4
atom     67     51  H     "Ammonium Ion H4N+"          1    1.0080  1
atom     68     52  N     "Methyl Amine N"             7   14.0070  3
atom     69     53  H     "Methyl Amine H2N"           1    1.0080  1
atom     70     43  C     "Methyl Amine CH3"           6   12.0110  4
atom     71     54  H     "Methyl Amine H3C"           1    1.0080  1
atom     72     52  N     "Ethyl Amine N"              7   14.0070  3
atom     73     53  H     "Ethyl Amine H2N"            1    1.0080  1
atom     74     43  C     "Ethyl Amine CH2"            6   12.0110  4
atom     75     54  H     "Ethyl Amine H2C"            1    1.0080  1
atom     76     43  C     "Ethyl Amine CH3"            6   12.0110  4
atom     77     44  H     "Ethyl Amine H3C"            1    1.0080  1
atom     78     43  C     "Propyl Amine CH3"           6   12.0110  4
atom     79     44  H     "Propyl Amine H3C"           1    1.0080  1
atom     80     43  C     "Propyl Amine Me-CH2"        6   12.0110  4
atom     81     45  H     "Propyl Amine Me-CH2"        1    1.0080  1
atom     82     52  N     "Dimethyl Amine N"           7   14.0070  3
atom     83     53  H     "Dimethyl Amine HN"          1    1.0080  1
atom     84     43  C     "Dimethyl Amine CH3"         6   12.0110  4
atom     85     54  H     "Dimethyl Amine H3C"         1    1.0080  1
atom     86     52  N     "Trimethyl Amine N"          7   14.0070  3
atom     87     43  C     "Trimethyl Amine CH3"        6   12.0110  4
atom     88     54  H     "Trimethyl Amine H3C"        1    1.0080  1
atom     89     52  N     "Pyrrolidine N"              7   14.0070  3
atom     90     53  H     "Pyrrolidine HN"             1    1.0080  1
atom     91     43  C     "Pyrrolidine C-CH2-C"        6   12.0110  4
atom     92     55  H     "Pyrrolidine C-CH2-C"        1    1.0080  1
atom     93     43  C     "Pyrrolidine CH2-N"          6   12.0110  4
atom     94     55  H     "Pyrrolidine H2C-N"          1    1.0080  1
atom     95     52  N     "NMePyrrolidine N"           7   14.0070  3
atom     96     43  C     "NMePyrrolidine CH2-N"       6   12.0110  4
atom     97     55  H     "NMePyrrolidine H2C-N"       1    1.0080  1
atom     98     43  C     "NMePyrrolidine CH2<"        6   12.0110  4
atom     99     55  H     "NMePyrrolidine H2C<"        1    1.0080  1
atom    100     43  C     "NMePyrrolidine CH3-N"       6   12.0110  4
atom    101     45  H     "NMePyrrolidine H3C-N"       1    1.0080  1
atom    102     56  C     "Formamide C=O"              6   12.0110  3
atom    103     57  H     "Formamide HCO"              1    1.0080  1
atom    104     58  O     "Formamide O"                8   15.9990  1
atom    105     59  N     "Formamide N"                7   14.0070  3
atom    106     60  H     "Formamide H2N"              1    1.0080  1
atom    107     56  C     "Acetamide C=O"              6   12.0110  3
atom    108     58  O     "Acetamide O"                8   15.9990  1
atom    109     59  N     "Acetamide N"                7   14.0070  3
atom    110     60  H     "Acetamide H2N"              1    1.0080  1
atom    111     43  C     "Acetamide CH3"              6   12.0110  4
atom    112     61  H     "Acetamide H3C"              1    1.0080  1
atom    113     43  C     "Propamide Me-CH2"           6   12.0110  4
atom    114     45  H     "Propamide Me-CH2"           1    1.0080  1
atom    115     43  C     "Propamide CH3"              6   12.0110  4
atom    116     44  H     "Propamide H3C"              1    1.0080  1
atom    117     56  C     "NMeFormamide C=O"           6   12.0110  3
atom    118     57  H     "NMeFormamide HCO"           1    1.0080  1
atom    119     58  O     "NMeFormamide O"             8   15.9990  1
atom    120     59  N     "NMeFormamide N"             7   14.0070  3
atom    121     60  H     "NMeFormamide HN"            1    1.0080  1
atom    122     43  C     "NMeFormamide CH3"           6   12.0110  4
atom    123     62  H     "NMeFormamide H3C"           1    1.0080  1
atom    124     43  C     "NEtFormamide CH2-N"         6   12.0110  4
atom    125     43  C     "NEtFormamide CH3-"          6   12.0110  4
atom    126     44  H     "NEtFormamide H3C"           1    1.0080  1
atom    127     56  C     "NMeAcetamide C=O"           6   12.0110  3
atom    128     58  O     "NMeAcetamide O"             8   15.9990  1
atom    129     59  N     "NMeAcetamide N"             7   14.0070  3
atom    130     60  H     "NMeAcetamide HN"            1    1.0080  1
atom    131     43  C     "NMeAcetamide CH3-N"         6   12.0110  4
atom    132     62  H     "NMeAcetamide H3C-N"         1    1.0080  1
atom    133     43  C     "NMeAcetamide CH3-C"         6   12.0110  4
atom    134     61  H     "NMeAcetamide H3C-C"         1    1.0080  1
atom    135     56  C     "DiMeFormamide C=O"          6   12.0110  3
atom    136     57  H     "DiMeFormamide HCO"          1    1.0080  1
atom    137     58  O     "DiMeFormamide O"            8   15.9990  1
atom    138     59  N     "DiMeFormamide N"            7   14.0070  3
atom    139     43  C     "DiMeFormamide CH3"          6   12.0110  4
atom    140     62  H     "DiMeFormamide H3C"          1    1.0080  1
atom    141     56  C     "DiMeAcetamide C=O"          6   12.0110  3
atom    142     58  O     "DiMeAcetamide O"            8   15.9990  1
atom    143     59  N     "DiMeAcetamide N"            7   14.0070  3
atom    144     43  C     "DiMeAcetamide CH3-N"        6   12.0110  4
atom    145     62  H     "DiMeAcetamide H3C-N"        1    1.0080  1
atom    146     43  C     "DiMeAcetamide CH3-C"        6   12.0110  4
atom    147     61  H     "DiMeAcetamide H3C-C"        1    1.0080  1
atom    148     63  O     "Formic Acid OH"             8   15.9990  2
atom    149     64  H     "Formic Acid HO"             1    1.0080  1
atom    150     65  C     "Formic Acid C=O"            6   12.0110  3
atom    151     58  O     "Formic Acid O=C"            8   15.9990  1
atom    152     66  H     "Formic Acid HC=O"           1    1.0080  1
atom    153     63  O     "Acetic Acid OH"             8   15.9990  2
atom    154     64  H     "Acetic Acid HO"             1    1.0080  1
atom    155     65  C     "Acetic Acid C=O"            6   12.0110  3
atom    156     58  O     "Acetic Acid O=C"            8   15.9990  1
atom    157     43  C     "Acetic Acid CH3"            6   12.0110  4
atom    158     67  H     "Acetic Acid H3C"            1    1.0080  1
atom    159     65  C     "Formaldehyde C=O"           6   12.0110  3
atom    160     58  O     "Formaldehyde O=C"           8   15.9990  1
atom    161     66  H     "Formaldehyde HC=O"          1    1.0080  1
atom    162     65  C     "Acetaldehyde C=O"           6   12.0110  3
atom    163     58  O     "Acetaldehyde O=C"           8   15.9990  1
atom    164     43  C     "Acetaldehyde CH3"           6   12.0110  4
atom    165     67  H     "Acetaldehyde H3C"           1    1.0080  1
atom    166     66  H     "Acetaldehyde HC=O"          1    1.0080  1
atom    167     68  S     "Hydrogen Sulfide S"        16   32.0660  2
atom    168     69  H     "Hydrogen Sulfide H2S"       1    1.0080  1
atom    169     70  S     "Methyl Sulfide S"          16   32.0660  2
atom    170     71  H     "Methyl Sulfide HS"          1    1.0080  1
atom    171     65  C     "Methyl Sulfide CH3"         6   12.0110  4
atom    172     72  H     "Methyl Sulfide H3C"         1    1.0080  1
atom    173     70  S     "Dimethyl Sulfide S"        16   32.0660  2
atom    174     65  C     "Dimethyl Sulfide CH3"       6   12.0110  4
atom    175     72  H     "Dimethyl Sulfide H3C"       1    1.0080  1
atom    176     70  S     "Dimethyl Disulfide S"      16   32.0660  2
atom    177     65  C     "Dimethyl Disulfide CH3"     6   12.0110  4
atom    178     72  H     "Dimethyl Disulfide H3C"     1    1.0080  1
atom    179     70  S     "Ethyl Sulfide S"           16   32.0660  2
atom    180     71  H     "Ethyl Sulfide HS"           1    1.0080  1
atom    181     65  C     "Ethyl Sulfide CH2"          6   12.0110  4
atom    182     72  H     "Ethyl Sulfide H2C"          1    1.0080  1
atom    183     73  C     "Ethyl Sulfide CH3"          6   12.0110  4
atom    184     74  H     "Ethyl Sulfide H3C"          1    1.0080  1
atom    185     70  S     "MeEt Sulfide S"            16   32.0660  2
atom    186     65  C     "MeEt Sulfide CH3-S"         6   12.0110  4
atom    187     72  H     "MeEt Sulfide H3C-S"         1    1.0080  1
atom    188     65  C     "MeEt Sulfide CH2-S"         6   12.0110  4
atom    189     72  H     "MeEt Sulfide CH2-S"         1    1.0080  1
atom    190     73  C     "MeEt Sulfide CH3-C"         6   12.0110  4
atom    191     74  H     "MeEt Sulfide H3C-C"         1    1.0080  1
atom    192     75  S     "Dimethyl Sulfoxide S=O"    16   32.0660  3
atom    193     76  O     "Dimethyl Sulfoxide S=O"     8   15.9990  1
atom    194     77  C     "Dimethyl Sulfoxide CH3"     6   12.0110  4
atom    195     78  H     "Dimethyl Sulfoxide H3C"     1    1.0080  1
atom    196     79  S     "Methyl Sulfonate SO3-"     16   32.0660  4
atom    197     80  O     "Methyl Sulfonate SO3-"      8   15.9990  1
atom    198     43  C     "Methyl Sulfonate CH3"       6   12.0110  4
atom    199     81  H     "Methyl Sulfonate H3C"       1    1.0080  1
atom    200     79  S     "Ethyl Sulfonate SO3-"      16   32.0660  4
atom    201     80  O     "Ethyl Sulfonate SO3-"       8   15.9990  1
atom    202     43  C     "Ethyl Sulfonate CH2"        6   12.0110  4
atom    203     81  H     "Ethyl Sulfonate H2C"        1    1.0080  1
atom    204     43  C     "Ethyl Sulfonate CH3"        6   12.0110  4
atom    205     44  H     "Ethyl Sulfonate H3C"        1    1.0080  1
atom    206     43  C     "Propyl Sulfonate Me-CH2"    6   12.0110  4
atom    207     45  H     "Propyl Sulfonate Me-CH2"    1    1.0080  1
atom    208     43  C     "Propyl Sulfonate CH3"       6   12.0110  4
atom    209     44  H     "Propyl Sulfonate H3C"       1    1.0080  1
atom    210     82  C     "Hydrogen Cyanide CN"        6   12.0110  2
atom    211     83  N     "Hydrogen Cyanide CN"        7   14.0070  1
atom    212     84  H     "Hydrogen Cyanide HCN"       1    1.0080  1
atom    213     82  C     "Acetonitrile CN"            6   12.0110  2
atom    214     83  N     "Acetonitrile CN"            7   14.0070  1
atom    215     85  C     "Acetonitrile CH3"           6   12.0110  4
atom    216     86  H     "Acetonitrile H3C"           1    1.0080  1
atom    217     87  C     "Tricyanomethide CN"         6   12.0110  2
atom    218     88  N     "Tricyanomethide CN"         7   14.0070  1
atom    219     89  C     "Tricyanomethide >C-"        6   12.0110  3
atom    220     90  C     "Benzene C"                  6   12.0110  3
atom    221     91  H     "Benzene HC"                 1    1.0080  1
atom    222     92  C     "Ethylbenzene C1-CH2"        6   12.0110  3
atom    223     92  C     "Ethylbenzene C2"            6   12.0110  3
atom    224     92  C     "Ethylbenzene C3"            6   12.0110  3
atom    225     92  C     "Ethylbenzene C4"            6   12.0110  3
atom    226     93  H     "Ethylbenzene H2"            1    1.0080  1
atom    227     93  H     "Ethylbenzene H3"            1    1.0080  1
atom    228     93  H     "Ethylbenzene H4"            1    1.0080  1
atom    229     43  C     "Ethylbenzene CH2"           6   12.0110  4
atom    230     44  H     "Ethylbenzene H2C"           1    1.0080  1
atom    231     43  C     "Ethylbenzene CH3"           6   12.0110  4
atom    232     44  H     "Ethylbenzene H3C"           1    1.0080  1
atom    233     39  O     "Phenol OH"                  8   15.9990  2
atom    234     40  H     "Phenol HO"                  1    1.0080  1
atom    235     92  C     "Phenol C1-OH"               6   12.0110  3
atom    236     92  C     "Phenol C2"                  6   12.0110  3
atom    237     92  C     "Phenol C3"                  6   12.0110  3
atom    238     92  C     "Phenol C4"                  6   12.0110  3
atom    239     93  H     "Phenol H2"                  1    1.0080  1
atom    240     93  H     "Phenol H3"                  1    1.0080  1
atom    241     93  H     "Phenol H4"                  1    1.0080  1
atom    242     43  C     "Toluene CH3"                6   12.0110  4
atom    243     44  H     "Toluene H3C"                1    1.0080  1
atom    244     92  C     "Toluene C1-CH3"             6   12.0110  3
atom    245     92  C     "Toluene C2"                 6   12.0110  3
atom    246     92  C     "Toluene C3"                 6   12.0110  3
atom    247     92  C     "Toluene C4"                 6   12.0110  3
atom    248     93  H     "Toluene H2"                 1    1.0080  1
atom    249     93  H     "Toluene H3"                 1    1.0080  1
atom    250     93  H     "Toluene H4"                 1    1.0080  1
atom    251     39  O     "p-Cresol OH"                8   15.9990  2
atom    252     40  H     "p-Cresol HO"                1    1.0080  1
atom    253     43  C     "p-Cresol CH3"               6   12.0110  4
atom    254     54  H     "p-Cresol H3C"               1    1.0080  1
atom    255     92  C     "p-Cresol C1-CH3"            6   12.0110  3
atom    256     92  C     "p-Cresol C2"                6   12.0110  3
atom    257     92  C     "p-Cresol C3"                6   12.0110  3
atom    258     92  C     "p-Cresol C4-OH"             6   12.0110  3
atom    259     93  H     "p-Cresol H2"                1    1.0080  1
atom    260     93  H     "p-Cresol H3"                1    1.0080  1
atom    261     94  N     "Imidazole NH"               7   14.0070  3
atom    262     49  H     "Imidazole HN"               1    1.0080  1
atom    263     95  C     "Imidazole N-C-N"            6   12.0110  3
atom    264     96  H     "Imidazole HC"               1    1.0080  1
atom    265     94  N     "Imidazole N=C-"             7   14.0070  2
atom    266     95  C     "Imidazole C-N=C"            6   12.0110  3
atom    267     96  H     "Imidazole HC"               1    1.0080  1
atom    268     95  C     "Imidazole C-NH-"            6   12.0110  3
atom    269     96  H     "Imidazole HC"               1    1.0080  1
atom    270     43  C     "4-Ethylimidazole CH2"       6   12.0110  4
atom    271     44  H     "4-Ethylimidazole H2C"       1    1.0080  1
atom    272     43  C     "4-Ethylimidazole CH3"       6   12.0110  4
atom    273     44  H     "4-Ethylimidazole H3C"       1    1.0080  1
atom    274     94  N     "4-Ethylimidazole ND"        7   14.0070  3
atom    275     49  H     "4-Ethylimidazole HND"       1    1.0080  1
atom    276     95  C     "4-Ethylimidazole CE"        6   12.0110  3
atom    277     96  H     "4-Ethylimidazole HCE"       1    1.0080  1
atom    278     94  N     "4-Ethylimidazole NE"        7   14.0070  3
atom    279     49  H     "4-Ethylimidazole HNE"       1    1.0080  1
atom    280     95  C     "4-Ethylimidazole CD"        6   12.0110  3
atom    281     96  H     "4-Ethylimidazole HCD"       1    1.0080  1
atom    282     95  C     "4-Ethylimidazole CG"        6   12.0110  3
atom    283     94  N     "Indole N"                   7   14.0070  3
atom    284     49  H     "Indole HN"                  1    1.0080  1
atom    285     97  C     "Indole C2"                  6   12.0110  3
atom    286     97  C     "Indole C3"                  6   12.0110  3
atom    287     97  C     "Indole C4"                  6   12.0110  3
atom    288     97  C     "Indole C5"                  6   12.0110  3
atom    289     97  C     "Indole C6"                  6   12.0110  3
atom    290     97  C     "Indole C7"                  6   12.0110  3
atom    291     97  C     "Indole C3a"                 6   12.0110  3
atom    292     97  C     "Indole C7a"                 6   12.0110  3
atom    293     91  H     "Indole HC2"                 1    1.0080  1
atom    294     91  H     "Indole HC3"                 1    1.0080  1
atom    295     91  H     "Indole HC4"                 1    1.0080  1
atom    296     91  H     "Indole HC5"                 1    1.0080  1
atom    297     91  H     "Indole HC6"                 1    1.0080  1
atom    298     91  H     "Indole HC7"                 1    1.0080  1
atom    299     94  N     "3-Ethylindole N"            7   14.0070  3
atom    300     49  H     "3-Ethylindole HN"           1    1.0080  1
atom    301     97  C     "3-Ethylindole C2"           6   12.0110  3
atom    302     97  C     "3-Ethylindole C3"           6   12.0110  3
atom    303     97  C     "3-Ethylindole C4"           6   12.0110  3
atom    304     97  C     "3-Ethylindole C5"           6   12.0110  3
atom    305     97  C     "3-Ethylindole C6"           6   12.0110  3
atom    306     97  C     "3-Ethylindole C7"           6   12.0110  3
atom    307     97  C     "3-Ethylindole C3a"          6   12.0110  3
atom    308     97  C     "3-Ethylindole C7a"          6   12.0110  3
atom    309     91  H     "3-Ethylindole HC2"          1    1.0080  1
atom    310     91  H     "3-Ethylindole HC4"          1    1.0080  1
atom    311     91  H     "3-Ethylindole HC5"          1    1.0080  1
atom    312     91  H     "3-Ethylindole HC6"          1    1.0080  1
atom    313     91  H     "3-Ethylindole HC7"          1    1.0080  1
atom    314     98  C     "3-Ethylindole CH2"          6   12.0110  4
atom    315     44  H     "3-Ethylindole H2C"          1    1.0080  1
atom    316     98  C     "3-Ethylindole CH3"          6   12.0110  4
atom    317     44  H     "3-Ethylindole H3C"          1    1.0080  1
atom    318     94  N     "3-Formylindole N"           7   14.0070  3
atom    319     49  H     "3-Formylindole HN"          1    1.0080  1
atom    320     97  C     "3-Formylindole C2"          6   12.0110  3
atom    321     97  C     "3-Formylindole C3"          6   12.0110  3
atom    322     97  C     "3-Formylindole C4"          6   12.0110  3
atom    323     97  C     "3-Formylindole C5"          6   12.0110  3
atom    324     97  C     "3-Formylindole C6"          6   12.0110  3
atom    325     97  C     "3-Formylindole C7"          6   12.0110  3
atom    326     97  C     "3-Formylindole C3a"         6   12.0110  3
atom    327     97  C     "3-Formylindole C7a"         6   12.0110  3
atom    328     91  H     "3-Formylindole HC2"         1    1.0080  1
atom    329     91  H     "3-Formylindole HC4"         1    1.0080  1
atom    330     91  H     "3-Formylindole HC5"         1    1.0080  1
atom    331     91  H     "3-Formylindole HC6"         1    1.0080  1
atom    332     91  H     "3-Formylindole HC7"         1    1.0080  1
atom    333     56  C     "3-Formylindole C=O"         6   12.0110  3
atom    334     99  O     "3-Formylindole O=C"         8   15.9990  1
atom    335     66  H     "3-Formylindole HC=O"        1    1.0080  1
atom    336    100  N     "Benzamidine N"              7   14.0070  3
atom    337    101  H     "Benzamidine HN"             1    1.0080  1
atom    338    102  C     "Benzamidine N-C-N"          6   12.0110  3
atom    339     92  C     "Benzamidine C1-CN2"         6   12.0110  3
atom    340     92  C     "Benzamidine C2"             6   12.0110  3
atom    341     92  C     "Benzamidine C3"             6   12.0110  3
atom    342     92  C     "Benzamidine C4"             6   12.0110  3
atom    343     93  H     "Benzamidine H2"             1    1.0080  1
atom    344     93  H     "Benzamidine H3"             1    1.0080  1
atom    345     93  H     "Benzamidine H4"             1    1.0080  1
atom    346    103  N     "Pyridinium N"               7   14.0070  3
atom    347     90  C     "Pyridinium C2"              6   12.0110  3
atom    348     90  C     "Pyridinium C3"              6   12.0110  3
atom    349     90  C     "Pyridinium C4"              6   12.0110  3
atom    350    104  H     "Pyridinium HN"              1    1.0080  1
atom    351     91  H     "Pyridinium H2"              1    1.0080  1
atom    352     91  H     "Pyridinium H3"              1    1.0080  1
atom    353     91  H     "Pyridinium H4"              1    1.0080  1

bond     21     22  1072.00   1.1874
bond     23     24   320.00   1.3900
bond     25     26   350.00   1.6260
bond     27     27  1613.00   1.0980
bond     28     29   395.50   1.0835
bond     30     30   323.00   1.5247
bond     30     31   341.00   1.1020
bond     30     32   323.00   1.5247
bond     30     34   323.00   1.5247
bond     32     32   323.00   1.5247
bond     32     33   341.00   1.1120
bond     34     35   341.00   1.1120
bond     36     92   453.20   1.4950
bond     37     38   556.85   0.9572
bond     39     40   615.90   0.9670
bond     39     41   500.10   1.4130
bond     39     43   465.10   1.4130
bond     39     46   410.10   1.4130
bond     39     92   676.60   1.3550
bond     41     42   385.00   1.1120
bond     42     43   385.00   1.1120
bond     42     46   341.00   1.1120
bond     43     43   453.00   1.5247
bond     43     44   385.00   1.1120
bond     43     45   385.00   1.1120
bond     43     46   323.00   1.5247
bond     43     47   378.00   1.1120
bond     43     52   381.30   1.4655
bond     43     54   385.00   1.0860
bond     43     55   341.00   1.1120
bond     43     56   345.30   1.5090
bond     43     59   374.80   1.4460
bond     43     61   341.00   1.1120
bond     43     62   341.00   1.1120
bond     43     65   345.30   1.5090
bond     43     67   341.00   1.1120
bond     43     79   220.00   1.8015
bond     43     81   341.00   1.1120
bond     43     92   453.20   1.4990
bond     43     95   453.20   1.4930
bond     44     98   341.00   1.1120
bond     48     49   516.50   1.0120
bond     49     94   467.60   1.0300
bond     50     51   461.90   1.0150
bond     52     53   515.90   1.0100
bond     56     57   356.40   1.1004
bond     56     58   601.80   1.2183
bond     56     59   482.00   1.3639
bond     56     66   314.40   1.0907
bond     56     97   345.30   1.5090
bond     56     99   705.00   1.2053
bond     58     65   705.00   1.2255
bond     59     60   542.00   1.0034
bond     63     64   514.40   0.9737
bond     63     65   431.60   1.3498
bond     65     66   314.40   1.0907
bond     65     70   235.80   1.8250
bond     65     72   395.50   1.0850
bond     65     73   323.00   1.5247
bond     68     69   278.40   1.3420
bond     70     71   315.40   1.3320
bond     73     74   341.00   1.1120
bond     75     76   494.20   1.5100
bond     75     77   197.20   1.8062
bond     77     78   388.20   1.0893
bond     79     80   570.00   1.4780
bond     82     83  1195.00   1.1700
bond     82     84   462.00   1.0650
bond     82     85   380.00   1.4570
bond     85     86   390.00   1.0873
bond     87     88  1110.00   1.1530
bond     87     89   420.00   1.4065
bond     90     90   471.90   1.3820
bond     90     91   370.50   1.0790
bond     90    103   653.90   1.3550
bond     91     97   370.50   1.1010
bond     92     92   471.90   1.3820
bond     92     93   370.50   1.0790
bond     92    102   323.00   1.5250
bond     94     95   653.90   1.3450
bond     94     97   653.90   1.3550
bond     95     95   539.60   1.3520
bond     95     96   370.50   1.0810
bond     97     97   471.90   1.3887
bond     97     98   345.30   1.5090
bond     98     98   323.00   1.5247
bond    100    101   487.00   1.0280
bond    100    102   491.40   1.3250
bond    103    104   467.60   1.0300

multipole      1                        0.00000 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole      2                        0.00000 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole      3                        0.00000 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole      4                        0.00000 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole      5                        0.00000 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole      6                        1.00000 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole      7                        1.00000 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole      8                        1.00000 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole      9                        1.00000 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole     10                        1.00000 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole     11                        2.00000 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole     12                        2.00000 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole     13                        2.00000 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole     14                        2.00000 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole     15                        2.00000 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole     16                        2.00000 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole     17                       -1.00000 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole     18                       -1.00000 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole     19                       -1.00000 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole     20                       -1.00000 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole     21     22                -0.50825 \
                                        0.00000  0.00000  0.77400 \
                                       -0.03000 \
                                        0.00000 -0.03000 \
                                        0.00000  0.00000  0.06000
multipole     22     21                -0.49175 \
                                        0.00000  0.00000  0.59100 \
                                       -0.22500 \
                                        0.00000 -0.22500 \
                                        0.00000  0.00000  0.45000
multipole     23                        0.50724 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole     24     23                -0.37681 \
                                        0.00000  0.00000  0.35197 \
                                       -0.33840 \
                                        0.00000 -0.33840 \
                                        0.00000  0.00000  0.67680
multipole     25                        2.24240 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole     26     25                -0.54040 \
                                        0.00000  0.00000 -0.00975 \
                                       -0.21692 \
                                        0.00000 -0.21692 \
                                        0.00000  0.00000  0.43384
multipole     27     27                 0.00000 \
                                        0.00000  0.00000  0.12578 \
                                        0.16329 \
                                        0.00000  0.16329 \
                                        0.00000  0.00000 -0.32658
multipole     28     29     29         -0.22648 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole     29     28     29          0.05662 \
                                        0.00000  0.00000 -0.12142 \
                                       -0.00797 \
                                        0.00000 -0.00797 \
                                        0.00000  0.00000  0.01594
multipole     30     30     31         -0.17655 \
                                        0.00000  0.00000  0.04700 \
                                       -0.22275 \
                                        0.00000 -0.22275 \
                                        0.00000  0.00000  0.44550
multipole     31     30     30          0.05885 \
                                        0.03092  0.00000 -0.07878 \
                                       -0.00954 \
                                        0.00000 -0.03313 \
                                        0.00313  0.00000  0.04267
multipole     32     34     33         -0.16638 \
                                        0.00000  0.00000  0.25069 \
                                       -0.24574 \
                                        0.00000 -0.24574 \
                                        0.00000  0.00000  0.49148
multipole     32     36     33         -0.16638 \
                                        0.00000  0.00000  0.25069 \
                                       -0.24574 \
                                        0.00000 -0.24574 \
                                        0.00000  0.00000  0.49148
multipole     33     32     34          0.05546 \
                                        0.01102  0.00000 -0.10399 \
                                        0.00247 \
                                        0.00000 -0.01906 \
                                        0.00852  0.00000  0.01659
multipole     33     32     36          0.05546 \
                                        0.01102  0.00000 -0.10399 \
                                        0.00247 \
                                        0.00000 -0.01906 \
                                        0.00852  0.00000  0.01659
multipole     34     34     32         -0.12028 \
                                        0.33700  0.00000  0.22666 \
                                        0.34191 \
                                        0.00000 -0.72407 \
                                       -0.04985  0.00000  0.38216
multipole     34    -34    -34         -0.12028 \
                                        0.00000  0.00000  0.27522 \
                                        0.47728 \
                                        0.00000 -0.35302 \
                                        0.00000  0.00000 -0.12426
multipole     35     34     34          0.06014 \
                                        0.00606  0.00000 -0.08554 \
                                       -0.00370 \
                                        0.00000 -0.01833 \
                                        0.00546  0.00000  0.02203
multipole     36     37     32         -0.05646 \
                                        0.00000  0.00000 -0.19753 \
                                       -0.37464 \
                                        0.00000  0.21807 \
                                        0.19091  0.00000  0.15657
multipole     36     37     34         -0.05646 \
                                        0.00000  0.00000 -0.19753 \
                                       -0.37464 \
                                        0.00000  0.21807 \
                                        0.19091  0.00000  0.15657
multipole     36     37     36         -0.05646 \
                                        0.00000  0.00000 -0.19753 \
                                       -0.37464 \
                                        0.00000  0.21807 \
                                        0.19091  0.00000  0.15657
multipole     37     36     32          0.05646 \
                                       -0.00037  0.00000 -0.03746 \
                                       -0.01137 \
                                        0.00000 -0.01137 \
                                        0.00000  0.00000  0.02274
multipole     37     36     34          0.05646 \
                                       -0.00037  0.00000 -0.03746 \
                                       -0.01137 \
                                        0.00000 -0.01137 \
                                        0.00000  0.00000  0.02274
multipole     37     36     36          0.05646 \
                                       -0.00037  0.00000 -0.03746 \
                                       -0.01137 \
                                        0.00000 -0.01137 \
                                        0.00000  0.00000  0.02274
multipole     38                        0.00000 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole     39    -40    -40         -0.51966 \
                                        0.00000  0.00000  0.14279 \
                                        0.37928 \
                                        0.00000 -0.41809 \
                                        0.00000  0.00000  0.03881
multipole     40     39     40          0.25983 \
                                       -0.03859  0.00000 -0.05818 \
                                       -0.03673 \
                                        0.00000 -0.10739 \
                                       -0.00203  0.00000  0.14412
multipole     41     42     43         -0.53771 \
                                        0.23239  0.00000  0.14256 \
                                        0.21444 \
                                        0.00000 -0.55826 \
                                       -0.21095  0.00000  0.34382
multipole     42     41     43          0.24154 \
                                       -0.04246  0.00000  0.00000 \
                                       -0.06223 \
                                        0.00000 -0.12152 \
                                       -0.02736  0.00000  0.18375
multipole     43     41     42          0.17575 \
                                        0.00000  0.00000  0.57127 \
                                       -0.44733 \
                                        0.00000 -0.44733 \
                                        0.00000  0.00000  0.89466
multipole     44     43     41          0.04014 \
                                        0.00000  0.00000 -0.10668 \
                                       -0.00544 \
                                        0.00000 -0.02734 \
                                       -0.01699  0.00000  0.03278
multipole     45     46     47         -0.50793 \
                                        0.30397  0.00000  0.07443 \
                                        0.21785 \
                                        0.00000 -0.54387 \
                                       -0.22371  0.00000  0.32602
multipole     46     45     47          0.24956 \
                                       -0.04674  0.00000  0.00000 \
                                       -0.04536 \
                                        0.00000 -0.09867 \
                                       -0.01950  0.00000  0.14403
multipole     47     45     49          0.14897 \
                                        0.07697  0.00000  0.46667 \
                                       -0.22387 \
                                        0.00000 -0.51710 \
                                       -0.34700  0.00000  0.74097
multipole     47     45     51          0.17897 \
                                        0.07697  0.00000  0.46667 \
                                       -0.22387 \
                                        0.00000 -0.51710 \
                                       -0.34700  0.00000  0.74097
multipole     48     47     45          0.03392 \
                                       -0.01463  0.00000 -0.07700 \
                                       -0.00706 \
                                        0.00000 -0.01579 \
                                       -0.02154  0.00000  0.02285
multipole     49     47     50         -0.17399 \
                                        0.00000  0.00000  0.32694 \
                                       -0.23348 \
                                        0.00000 -0.31115 \
                                       -0.04183  0.00000  0.54463
multipole     50     49     47          0.07185 \
                                        0.00000  0.00000 -0.07829 \
                                       -0.02252 \
                                        0.00000 -0.03344 \
                                        0.01606  0.00000  0.05596
multipole     51     53     47         -0.13175 \
                                        0.27622  0.00000  0.18608 \
                                        0.22471 \
                                        0.00000 -0.57970 \
                                       -0.16099  0.00000  0.35499
multipole     52     51     53          0.06360 \
                                        0.00000  0.00000 -0.07581 \
                                       -0.01386 \
                                        0.00000 -0.02607 \
                                        0.00078  0.00000  0.03993
multipole     53     51     54         -0.16203 \
                                        0.00000  0.00000  0.32333 \
                                       -0.30615 \
                                        0.00000 -0.27981 \
                                        0.01123  0.00000  0.58596
multipole     54     53     51          0.05938 \
                                        0.00000  0.00000 -0.09019 \
                                       -0.01198 \
                                        0.00000 -0.03174 \
                                        0.00468  0.00000  0.04372
multipole     55     57     56         -0.53467 \
                                       -0.11997  0.00000  0.30509 \
                                       -0.12904 \
                                        0.00000 -0.41083 \
                                       -0.24252  0.00000  0.53987
multipole     56     55     57          0.34832 \
                                       -0.02310  0.00000 -0.09243 \
                                        0.02057 \
                                        0.00000 -0.02589 \
                                        0.01814  0.00000  0.00532
multipole     57     55     58          0.18465 \
                                       -0.00129  0.00000  0.27865 \
                                       -0.41290 \
                                        0.00000 -0.18381 \
                                        0.28296  0.00000  0.59671
multipole     58     57     55         -0.00834 \
                                        0.00129  0.00000 -0.09710 \
                                       -0.00470 \
                                        0.00000 -0.00889 \
                                        0.01035  0.00000  0.01359
multipole     59     57     59         -0.12383 \
                                       -0.03880  0.00000  0.27670 \
                                       -0.21286 \
                                        0.00000 -0.18142 \
                                       -0.04969  0.00000  0.39428
multipole     60     59     57          0.04295 \
                                       -0.00542  0.00000 -0.10152 \
                                       -0.01487 \
                                        0.00000 -0.01382 \
                                       -0.00216  0.00000  0.02869
multipole     61     62     62         -0.32494 \
                                        0.53657  0.00000  0.37202 \
                                        0.44076 \
                                        0.00000 -0.87825 \
                                        0.00127  0.00000  0.43749
multipole     62     61     62          0.11615 \
                                       -0.19923  0.00000  0.19298 \
                                       -0.23681 \
                                        0.00000 -0.41373 \
                                       -0.10899  0.00000  0.65054
multipole     63     62     61          0.01544 \
                                        0.04231  0.00000 -0.02407 \
                                       -0.01587 \
                                        0.00000 -0.05904 \
                                        0.03668  0.00000  0.07491
multipole     64    -65    -65    -65  -0.22011 \
                                        0.00000  0.00000  0.29395 \
                                        0.35844 \
                                        0.00000  0.35844 \
                                        0.00000  0.00000 -0.71688
multipole     65     64    -65    -65   0.07337 \
                                       -0.01503  0.00000 -0.16505 \
                                       -0.05100 \
                                        0.00000  0.04892 \
                                        0.02991  0.00000  0.00208
multipole     66     67     67         -0.22892 \
                                        0.00000  0.00000  0.00000 \
                                        0.00000 \
                                        0.00000  0.00000 \
                                        0.00000  0.00000  0.00000
multipole     67     66     67          0.30723 \
                                        0.00000  0.00000  0.04225 \
                                       -0.07085 \
                                        0.00000 -0.07085 \
                                        0.00000  0.00000  0.14170
multipole     68     70    -69    -69  -0.73235 \
                                       -0.06766  0.00000  0.50053 \
                                       -0.78586 \
                                        0.00000  0.11843 \
                                       -0.42729  0.00000  0.66743
multipole     69     68     70          0.30411 \
                                       -0.01655  0.00000 -0.04238 \
                                        0.05116 \
                                        0.00000  0.01731 \
                                       -0.03326  0.00000 -0.06847
multipole     70     68     71          0.13715 \
                                        0.00000  0.00000  0.30940 \
                                       -0.22698 \
                                        0.00000 -0.17804 \
                                        0.14974  0.00000  0.40502
multipole     71     70     68         -0.00434 \
                                        0.00527  0.00000 -0.12660 \
                                        0.09141 \
                                        0.00000  0.00598 \
                                       -0.00549  0.00000 -0.09739
multipole     72     74    -73    -73  -0.78457 \
                                       -0.13919  0.00000  0.43672 \
                                       -0.60031 \
                                        0.00000 -0.00688 \
                                       -0.14251  0.00000  0.60719
multipole     73     72     74          0.33429 \
                                        0.01550  0.00000 -0.07147 \
                                        0.09104 \
                                        0.00000  0.00656 \
                                        0.06677  0.00000 -0.09760
multipole     74     72     76          0.07533 \
                                        0.02126  0.00000  0.27273 \
                                       -0.11070 \
                                        0.00000 -0.44964 \
                                       -0.22608  0.00000  0.56034
multipole     74     72     80          0.03849 \
                                        0.02126  0.00000  0.27273 \
                                       -0.11070 \
                                        0.00000 -0.44964 \
                                       -0.22608  0.00000  0.56034
multipole     75     74     72          0.03287 \
                                       -0.00328  0.00000 -0.11206 \
                                        0.05082 \
                                        0.00000  0.01536 \
                                       -0.10743  0.00000 -0.06618
multipole     76     74     77         -0.13077 \
                                        0.00000  0.00000  0.17419 \
                                       -0.25148 \
                                        0.00000 -0.02794 \
                                       -0.03628  0.00000  0.27942
multipole     77     76     74          0.03523 \
                                        0.01099  0.00000 -0.09907 \
                                        0.07159 \
                                        0.00000  0.01975 \
                                       -0.06636  0.00000 -0.09134
multipole     78     80     79         -0.16203 \
                                        0.00000  0.00000  0.32333 \
                                       -0.30615 \
                                        0.00000 -0.27981 \
                                        0.01123  0.00000  0.58596
multipole     79     78     80          0.05938 \
                                        0.00000  0.00000 -0.09019 \
                                       -0.01198 \
                                        0.00000 -0.03174 \
                                        0.00468  0.00000  0.04372
multipole     80     78     74         -0.13155 \
                                        0.27622  0.00000  0.18608 \
                                        0.22471 \
                                        0.00000 -0.57970 \
                                       -0.16099  0.00000  0.35499
multipole     81     80     78          0.06360 \
                                        0.00000  0.00000 -0.07581 \
                                       -0.01386 \
                                        0.00000 -0.02607 \
                                        0.00078  0.00000  0.03993
multipole     82     83    -84    -84  -0.50428 \
                                        0.44556  0.00000 -0.40528 \
                                       -0.46816 \
                                        0.00000  0.41972 \
                                       -0.53357  0.00000  0.04844
multipole     83     82     84          0.31436 \
                                        0.00000  0.00000 -0.01317 \
                                       -0.01675 \
                                        0.00000 -0.11749 \
                                        0.00000  0.00000  0.13424
multipole     84     82     84          0.03586 \
                                       -0.08099  0.00000  0.35884 \
                                       -0.28498 \
                                        0.00000 -0.43341 \
                                        0.18616  0.00000  0.71839
multipole     85     84     82          0.01970 \
                                       -0.00547  0.00000 -0.11748 \
                                        0.03191 \
                                        0.00000  0.06495 \
                                       -0.07663  0.00000 -0.09686
multipole     86     87    -87    -87  -0.19506 \
                                        0.64617  0.00000  0.22216 \
                                       -0.71281 \
                                        0.00000  0.37641 \
                                       -0.42297  0.00000  0.33640
multipole     87     86    -87    -87   0.00472 \
                                       -0.12628  0.00000  0.36014 \
                                       -0.65998 \
                                        0.00000 -0.16196 \
                                        0.18288  0.00000  0.82194
multipole     88     87     86          0.02010 \
                                        0.00237  0.00000 -0.10127 \
                                        0.04286 \
                                        0.00000  0.02869 \
                                       -0.01037  0.00000 -0.07155
multipole     89     90    -93    -93  -0.35208 \
                                        0.53462  0.00000 -0.10752 \
                                       -0.37199 \
                                        0.00000  0.11075 \
                                       -0.27388  0.00000  0.26124
multipole     90     89     93          0.10040 \
                                       -0.01272  0.00000 -0.10118 \
                                       -0.00613 \
                                        0.00000 -0.01791 \
                                       -0.00220  0.00000  0.02404
multipole     91     93     91         -0.19964 \
                                        0.22355  0.00000  0.20213 \
                                        0.29715 \
                                        0.00000 -0.50142 \
                                       -0.18234  0.00000  0.20427
multipole     92     91     93          0.07729 \
                                        0.00000  0.00000 -0.06322 \
                                       -0.00431 \
                                        0.00000 -0.00800 \
                                        0.01053  0.00000  0.01231
multipole     93     89     91          0.04684 \
                                        0.24638  0.00000  0.26382 \
                                        0.13003 \
                                        0.00000 -0.69427 \
                                       -0.14259  0.00000  0.56424
multipole     94     93     89          0.06203 \
                                       -0.02660  0.00000 -0.11082 \
                                       -0.02038 \
                                        0.00000  0.00233 \
                                       -0.01687  0.00000  0.01805
multipole     95    100    -96    -96  -0.16386 \
                                        0.86090  0.00000  0.17248 \
                                       -0.08613 \
                                        0.00000  0.06267 \
                                       -0.63594  0.00000  0.02346
multipole     96     95     98          0.05185 \
                                        0.13228  0.00000  0.30434 \
                                        0.06680 \
                                        0.00000 -0.61847 \
                                       -0.12599  0.00000  0.55167
multipole     97     96     97          0.00527 \
                                        0.00406  0.00000 -0.10764 \
                                       -0.01340 \
                                        0.00000 -0.01393 \
                                        0.00177  0.00000  0.02733
multipole     98     96     98         -0.09279 \
                                        0.22151  0.00000  0.21417 \
                                        0.13087 \
                                        0.00000 -0.35686 \
                                       -0.20050  0.00000  0.22599
multipole     99     98     99          0.04373 \
                                        0.01196  0.00000 -0.08273 \
                                       -0.01875 \
                                        0.00000 -0.01896 \
                                        0.00134  0.00000  0.03771
multipole    100     95    101         -0.02496 \
                                        0.04979  0.00000  0.29801 \
                                       -0.38717 \
                                        0.00000 -0.44363 \
                                        0.10820  0.00000  0.83080
multipole    101    100     95          0.02490 \
                                       -0.00991  0.00000 -0.11456 \
                                       -0.01289 \
                                        0.00000 -0.01285 \
                                       -0.00610  0.00000  0.02574
multipole    102    104    105          0.68400 \
                                        0.35855  0.00000  0.35024 \
                                       -0.16615 \
                                        0.00000  0.05785 \
                                       -0.18250  0.00000  0.10830
multipole    103    102    104         -0.00966 \
                                        0.04692  0.00000 -0.16916 \
                                        0.04863 \
                                        0.00000  0.00186 \
                                        0.02467  0.00000 -0.05049
multipole    104    102    105         -0.66032 \
                                       -0.11037  0.00000 -0.02173 \
                                       -0.47187 \
                                        0.00000  0.06623 \
                                       -0.17201  0.00000  0.40564
multipole    105    102    104         -0.28852 \
                                       -0.05862  0.00000 -0.09300 \
                                        0.58777 \
                                        0.00000 -1.01585 \
                                       -0.12557  0.00000  0.42808
multipole    106    105    102          0.13725 \
                                        0.00573  0.00000 -0.15670 \
                                       -0.00132 \
                                        0.00000 -0.06288 \
                                        0.01422  0.00000  0.06420
multipole    107    108    109          0.69704 \
                                        0.32439  0.00000  0.34585 \
                                        0.04129 \
                                        0.00000 -0.08955 \
                                       -0.08531  0.00000  0.04826
multipole    108    107    109         -0.66360 \
                                       -0.08498  0.00000  0.01193 \
                                       -0.55576 \
                                        0.00000  0.07729 \
                                       -0.11662  0.00000  0.47847
multipole    109    107    108         -0.34707 \
                                        0.00433  0.00000 -0.17817 \
                                        0.76240 \
                                        0.00000 -0.95193 \
                                       -0.04518  0.00000  0.18953
multipole    110    109    107          0.13083 \
                                       -0.00017  0.00000 -0.15549 \
                                        0.00490 \
                                        0.00000 -0.06975 \
                                       -0.00360  0.00000  0.06485
multipole    111    107    108         -0.19238 \
                                       -0.05630  0.00000  0.24000 \
                                       -0.15101 \
                                        0.00000 -0.08245 \
                                        0.04874  0.00000  0.23346
multipole    112    111    107          0.08145 \
                                        0.00000  0.00000 -0.09216 \
                                       -0.01356 \
                                        0.00000 -0.02534 \
                                        0.00133  0.00000  0.03890
multipole    113    107    108         -0.12704 \
                                        0.08569  0.00000 -0.08840 \
                                        0.31357 \
                                        0.00000  0.26378 \
                                        0.01921  0.00000 -0.57735
multipole    114    113    107          0.08145 \
                                        0.00000  0.00000 -0.09216 \
                                       -0.01356 \
                                        0.00000 -0.02534 \
                                        0.00133  0.00000  0.03890
multipole    115    113    116         -0.16203 \
                                        0.00000  0.00000  0.32333 \
                                       -0.30615 \
                                        0.00000 -0.27981 \
                                        0.01123  0.00000  0.58596
multipole    116    115    113          0.05938 \
                                        0.00000  0.00000 -0.09019 \
                                       -0.01198 \
                                        0.00000 -0.03174 \
                                        0.00468  0.00000  0.04372
multipole    117    119    120          0.65857 \
                                        0.41598  0.00000  0.37265 \
                                       -0.18173 \
                                        0.00000  0.06910 \
                                       -0.16554  0.00000  0.11263
multipole    118    117    119         -0.01588 \
                                        0.04813  0.00000 -0.16671 \
                                        0.05978 \
                                        0.00000  0.00638 \
                                        0.02414  0.00000 -0.06616
multipole    119    117    120         -0.67916 \
                                       -0.09581  0.00000  0.00698 \
                                       -0.39376 \
                                        0.00000 -0.01911 \
                                       -0.14889  0.00000  0.41287
multipole    120    117    119         -0.19685 \
                                        0.03810  0.00000 -0.16343 \
                                        0.75512 \
                                        0.00000 -1.07948 \
                                       -0.17807  0.00000  0.32436
multipole    121    120    117          0.06926 \
                                       -0.07490  0.00000 -0.17460 \
                                        0.02296 \
                                        0.00000 -0.06128 \
                                        0.00972  0.00000  0.03832
multipole    122    120    117         -0.00817 \
                                       -0.03257  0.00000  0.26271 \
                                       -0.36503 \
                                        0.00000 -0.20015 \
                                        0.00659  0.00000  0.56518
multipole    123    122    120          0.05741 \
                                        0.00000  0.00000 -0.08912 \
                                       -0.02815 \
                                        0.00000 -0.02091 \
                                       -0.00421  0.00000  0.04906
multipole    124    120    117          0.12999 \
                                        0.04290  0.00000  0.06605 \
                                        0.00941 \
                                        0.00000  0.03131 \
                                       -0.04157  0.00000 -0.04072
multipole    125    124    120          0.03407 \
                                       -0.00588  0.00831  0.04151 \
                                        0.04980 \
                                        0.05442  0.03448 \
                                       -0.02032  0.04044 -0.08428
multipole    127    128    129          0.64220 \
                                        0.22706  0.00000  0.31459 \
                                       -0.50118 \
                                        0.00000  0.23539 \
                                        0.02285  0.00000  0.26579
multipole    128    127    129         -0.66524 \
                                       -0.05964  0.00000 -0.00965 \
                                       -0.38021 \
                                        0.00000 -0.05967 \
                                       -0.12838  0.00000  0.43988
multipole    129    127    128         -0.18752 \
                                        0.20427  0.00000 -0.34027 \
                                        1.06373 \
                                        0.00000 -0.82316 \
                                        0.04814  0.00000 -0.24057
multipole    130    129    127          0.07726 \
                                       -0.01582  0.00000 -0.17196 \
                                        0.02821 \
                                        0.00000 -0.05415 \
                                        0.00463  0.00000  0.02594
multipole    131    129    127         -0.03623 \
                                        0.00000  0.00000  0.23240 \
                                       -0.39078 \
                                        0.00000 -0.13890 \
                                       -0.04627  0.00000  0.52968
multipole    132    131    129          0.06087 \
                                       -0.00898  0.00000 -0.08765 \
                                       -0.00712 \
                                        0.00000 -0.03030 \
                                       -0.02713  0.00000  0.03742
multipole    133    127    128         -0.24387 \
                                        0.00000  0.00000  0.07193 \
                                        0.28325 \
                                        0.00000  0.19307 \
                                        0.29847  0.00000 -0.47632
multipole    134    133    127          0.07693 \
                                        0.00000  0.00000 -0.08930 \
                                       -0.00778 \
                                        0.00000 -0.03132 \
                                        0.00708  0.00000  0.03910
multipole    135    137    138          0.61546 \
                                        0.34152  0.00000  0.30025 \
                                       -0.28519 \
                                        0.00000  0.03194 \
                                       -0.18758  0.00000  0.25325
multipole    136    135    137         -0.03132 \
                                        0.05682  0.00000 -0.15943 \
                                        0.04940 \
                                        0.00000  0.01244 \
                                        0.02463  0.00000 -0.06184
multipole    137    135    138         -0.67725 \
                                       -0.03839  0.00000  0.05139 \
                                       -0.35361 \
                                        0.00000 -0.08422 \
                                       -0.04480  0.00000  0.43783
multipole    138    135    137         -0.19791 \
                                        0.08128  0.00000 -0.16063 \
                                        0.77250 \
                                        0.00000 -0.95072 \
                                       -0.07925  0.00000  0.17822
multipole    139    138    135          0.00688 \
                                       -0.02610  0.00000  0.31443 \
                                       -0.28042 \
                                        0.00000 -0.19094 \
                                       -0.04366  0.00000  0.47136
multipole    140    139    138          0.04621 \
                                       -0.02617  0.00000 -0.09444 \
                                       -0.03433 \
                                        0.00000 -0.01491 \
                                       -0.01887  0.00000  0.04924
multipole    141    142    143          0.80568 \
                                        0.31418  0.00000  0.30936 \
                                        0.16264 \
                                        0.00000 -0.34513 \
                                       -0.12966  0.00000  0.18249
multipole    142    141    143         -0.76654 \
                                       -0.03160  0.00000 -0.15691 \
                                       -0.57523 \
                                        0.00000  0.31642 \
                                       -0.04180  0.00000  0.25881
multipole    143    141    142         -0.27849 \
                                        0.08827  0.07010 -0.39278 \
                                        0.75371 \
                                        0.00000 -0.88152 \
                                        0.04478  0.00000  0.12781
multipole    144    143    141         -0.01070 \
                                       -0.07637  0.00000  0.33533 \
                                       -0.45884 \
                                        0.00000 -0.31611 \
                                       -0.02300  0.00000  0.77495
multipole    145    144    143          0.04803 \
                                        0.00000  0.00000 -0.11050 \
                                        0.00177 \
                                        0.00000 -0.01118 \
                                       -0.00738  0.00000  0.00941
multipole    146    141    142         -0.27148 \
                                       -0.02865  0.00000  0.25409 \
                                       -0.19166 \
                                        0.00000 -0.03693 \
                                        0.08931  0.00000  0.22859
multipole    147    146    141          0.08135 \
                                        0.00000  0.00000 -0.08222 \
                                       -0.00361 \
                                        0.00000 -0.01208 \
                                        0.00930  0.00000  0.01569
multipole    148    150    149         -0.46919 \
                                        0.17702  0.00000  0.02746 \
                                        0.30493 \
                                        0.00001 -0.49979 \
                                       -0.33195  0.00000  0.19486
multipole    149    148    150          0.25776 \
                                       -0.04996  0.00000 -0.05293 \
                                       -0.10496 \
                                        0.00000 -0.10483 \
                                       -0.02100  0.00000  0.20979
multipole    150    151    148          0.75480 \
                                        0.47467  0.00000  0.23486 \
                                       -0.10721 \
                                        0.00000 -0.02052 \
                                       -0.49018  0.00000  0.12773
multipole    151    150    148         -0.60103 \
                                       -0.07976  0.00000 -0.03242 \
                                       -0.43271 \
                                        0.00000  0.10680 \
                                       -0.13721  0.00000  0.32591
multipole    152    150    151          0.05766 \
                                        0.01745  0.00000 -0.16520 \
                                        0.04785 \
                                        0.00000 -0.00670 \
                                        0.00836  0.00000 -0.04115
multipole    153    155    154         -0.51449 \
                                        0.17023  0.00000 -0.01931 \
                                        0.41976 \
                                        0.00000 -0.46569 \
                                       -0.31987  0.00000  0.04593
multipole    154    153    155          0.24812 \
                                       -0.06534  0.00000 -0.06940 \
                                       -0.09928 \
                                        0.00000 -0.08341 \
                                       -0.04437  0.00000  0.18269
multipole    155    156    153          0.79309 \
                                        0.44903  0.00000  0.22771 \
                                        0.16786 \
                                        0.00000 -0.19671 \
                                       -0.31142  0.00000  0.02885
multipole    156    155    153         -0.61662 \
                                       -0.08296  0.00000 -0.00320 \
                                       -0.50843 \
                                        0.00000  0.12249 \
                                       -0.13621  0.00000  0.38594
multipole    157    155    156         -0.18319 \
                                       -0.02790  0.00000  0.35976 \
                                       -0.10461 \
                                        0.00000 -0.11692 \
                                        0.04626  0.00000  0.22153
multipole    158    157    155          0.09103 \
                                       -0.01445  0.00000 -0.09273 \
                                       -0.01359 \
                                        0.00702 -0.02416 \
                                        0.00000  0.00000  0.03775
multipole    159    160    161          0.50491 \
                                        0.00000  0.00000  0.40735 \
                                       -0.55471 \
                                        0.00000  0.20992 \
                                        0.00000  0.00000  0.34479
multipole    160    159    161         -0.51381 \
                                        0.00000  0.00000  0.03694 \
                                       -0.46753 \
                                        0.00000  0.14362 \
                                        0.00000  0.00000  0.32391
multipole    161    159    160          0.00445 \
                                        0.00826  0.00000 -0.13618 \
                                        0.04855 \
                                        0.00000 -0.02218 \
                                       -0.01283  0.00000 -0.02637
multipole    162    163    164          0.54719 \
                                        0.03558  0.00000  0.38474 \
                                       -0.51526 \
                                        0.00000  0.15339 \
                                       -0.05746  0.00000  0.36187
multipole    163    162    164         -0.54061 \
                                       -0.05927  0.00000  0.03696 \
                                       -0.54551 \
                                        0.00000  0.14242 \
                                       -0.10982  0.00000  0.40309
multipole    164    162    163         -0.22361 \
                                       -0.01192  0.00000  0.24635 \
                                       -0.04230 \
                                        0.00000 -0.13918 \
                                        0.05210  0.00000  0.18148
multipole    165    164    162          0.07963 \
                                        0.00000  0.00000 -0.08270 \
                                       -0.01659 \
                                        0.00000 -0.02290 \
                                       -0.00527  0.00000  0.03949
multipole    166    162    163         -0.02186 \
                                        0.02389  0.00000 -0.16073 \
                                        0.04310 \
                                        0.00000 -0.01011 \
                                        0.01929  0.00000 -0.03299
multipole    167   -168   -168          0.23084 \
                                        0.00000  0.00000  0.49866 \
                                        1.54610 \
                                        0.00000 -2.21649 \
                                        0.00000  0.00000  0.67039
multipole    168    167    168         -0.11542 \
                                       -0.01880  0.00000 -0.26701 \
                                       -0.00334 \
                                        0.00000 -0.06496 \
                                       -0.01793  0.00000  0.06830
multipole    169    170    171          0.10186 \
                                        0.41482  0.00000  0.31682 \
                                        1.29701 \
                                        0.00000 -2.44834 \
                                       -0.60310  0.00000  1.15133
multipole    170    169    171         -0.11359 \
                                       -0.01493  0.00000 -0.23983 \
                                        0.01575 \
                                        0.00000 -0.08528 \
                                       -0.02660  0.00000  0.06953
multipole    171    169    172         -0.20403 \
                                        0.00000  0.00000  0.08076 \
                                       -0.06672 \
                                        0.00000 -0.20158 \
                                        0.00470  0.00000  0.26830
multipole    172    171    169          0.07192 \
                                        0.01185  0.00000 -0.10796 \
                                       -0.00170 \
                                        0.00000 -0.02645 \
                                       -0.00552  0.00000  0.02815
multipole    173   -174   -174         -0.18536 \
                                        0.00000  0.00000  0.69845 \
                                        1.74494 \
                                        0.00000 -2.90227 \
                                        0.00000  0.00000  1.15733
multipole    174    173    174          0.09754 \
                                       -0.06505  0.00000  0.62751 \
                                       -0.38369 \
                                        0.00000 -0.35868 \
                                        0.07336  0.00000  0.74237
multipole    175    174    173         -0.00162 \
                                       -0.08135  0.00000 -0.10752 \
                                       -0.02832 \
                                        0.00000  0.01779 \
                                       -0.08079  0.00000  0.01053
multipole    176    176    177         -0.15378 \
                                        0.47182  0.00000  0.35804 \
                                        1.33557 \
                                        0.00000 -2.74527 \
                                       -0.28170  0.00000  1.40970
multipole    177    176    176          0.13830 \
                                       -0.02096  0.00000  0.87668 \
                                       -0.42121 \
                                        0.00000 -0.34241 \
                                        0.03686  0.00000  0.76362
multipole    178    177    176          0.00516 \
                                       -0.13471  0.00000 -0.16285 \
                                        0.03143 \
                                        0.00000  0.04698 \
                                       -0.14145  0.00000 -0.07841
multipole    179    181    180         -0.35646 \
                                        0.01158  0.00000  0.38562 \
                                        0.89799 \
                                        0.00000 -2.59055 \
                                       -0.61964  0.00000  1.69256
multipole    180    179    181          0.20683 \
                                        0.03656  0.00000  0.23967 \
                                       -0.17006 \
                                        0.00000 -0.22209 \
                                        0.08133  0.00000  0.39215
multipole    181    179    183          0.04522 \
                                       -0.01580  0.00000  0.23138 \
                                       -0.86708 \
                                        0.00000 -0.05614 \
                                        0.02517  0.00000  0.92322
multipole    182    181    179         -0.00157 \
                                        0.02645  0.00000 -0.01401 \
                                       -0.10756 \
                                        0.00000  0.01205 \
                                        0.03041  0.00000  0.09551
multipole    183    181    179          0.06207 \
                                        0.00000  0.00000  0.28242 \
                                       -0.17130 \
                                        0.00005 -0.17329 \
                                       -0.03605  0.00005  0.34459
multipole    184    183    181          0.01516 \
                                       -0.01903  0.00000 -0.04771 \
                                       -0.06086 \
                                        0.00000 -0.04888 \
                                        0.00395  0.00000  0.10974
multipole    185    188    186         -0.51231 \
                                        0.34596  0.00000  0.23797 \
                                        1.44128 \
                                        0.00000 -2.68119 \
                                       -0.42800  0.00000  1.23991
multipole    186    185    188          0.19455 \
                                       -0.00724  0.00000  0.87776 \
                                       -0.49136 \
                                        0.00000 -0.45808 \
                                        0.13728  0.00000  0.94944
multipole    187    186    185         -0.00140 \
                                       -0.08817  0.00000 -0.11639 \
                                       -0.01709 \
                                        0.00000  0.02898 \
                                       -0.09187  0.00000 -0.01189
multipole    188    185    190          0.21136 \
                                        0.05894  0.00000  1.08244 \
                                       -0.83410 \
                                        0.00000 -0.39960 \
                                       -0.28758  0.00000  1.23370
multipole    189    188    185         -0.01700 \
                                       -0.16197  0.00000 -0.05262 \
                                       -0.07296 \
                                        0.00000  0.03911 \
                                       -0.14370  0.00000  0.03385
multipole    190    188    185          0.08583 \
                                       -0.00087  0.00000  0.36631 \
                                       -0.15926 \
                                        0.00000 -0.24306 \
                                       -0.00657  0.00000  0.40232
multipole    191    190    188          0.01959 \
                                       -0.01842  0.00000 -0.02389 \
                                       -0.05455 \
                                        0.00000 -0.05942 \
                                        0.02613  0.00000  0.11397
multipole    192    193   -194   -194   0.28761 \
                                        0.34263  0.00000  0.97464 \
                                       -0.69101 \
                                        0.00000  0.85372 \
                                       -0.23783  0.00000 -0.16271
multipole    193    192   -194   -194  -0.63423 \
                                       -0.03435  0.00000  0.26755 \
                                       -0.60034 \
                                        0.00000 -0.57370 \
                                        0.09678  0.00000  1.17404
multipole    194    192    193         -0.05355 \
                                       -0.08789  0.00000  0.54241 \
                                       -0.28219 \
                                        0.00000 -0.59075 \
                                       -0.20358  0.00000  0.87294
multipole    195    194    192          0.07562 \
                                       -0.01297  0.00000 -0.15656 \
                                        0.08665 \
                                        0.00000  0.07386 \
                                        0.01776  0.00000 -0.16051
multipole    196    198    197          0.68421 \
                                        0.00000  0.00000  0.04448 \
                                        0.24144 \
                                        0.00000  0.24144 \
                                        0.00000  0.00000 -0.48288
multipole    197    196    198         -0.59947 \
                                        0.02332  0.00000  0.46306 \
                                       -0.52310 \
                                        0.00000 -0.57116 \
                                       -0.00192  0.00000  1.09426
multipole    198    196    199         -0.12328 \
                                        0.00000  0.00000  0.20364 \
                                        0.03024 \
                                        0.00000  0.03024 \
                                        0.00000  0.00000 -0.06048
multipole    199    198    196          0.07916 \
                                        0.04006  0.00000  0.13850 \
                                       -0.05327 \
                                        0.00000 -0.09352 \
                                        0.00000  0.00000  0.14679
multipole    200    202    201          0.68359 \
                                        0.00000  0.00000  0.04182 \
                                        0.19805 \
                                        0.00000  0.19805 \
                                        0.00000  0.00000 -0.39610
multipole    201    200    202         -0.60332 \
                                        0.01993  0.00000  0.47399 \
                                       -0.51735 \
                                        0.00000 -0.59284 \
                                       -0.00125  0.00000  1.11019
multipole    202    200    204         -0.13070 \
                                        0.14439  0.00000  0.17369 \
                                        0.06183 \
                                        0.00000  0.00175 \
                                       -0.05422  0.00000 -0.06358
multipole    202    200    206         -0.13070 \
                                        0.14439  0.00000  0.17369 \
                                        0.06183 \
                                        0.00000  0.00175 \
                                       -0.05422  0.00000 -0.06358
multipole    203    202    200          0.09377 \
                                        0.02557  0.00000  0.17130 \
                                       -0.02736 \
                                        0.00000 -0.07299 \
                                       -0.03928  0.00000  0.10035
multipole    204    202    205         -0.13840 \
                                        0.00164  0.00000  0.15569 \
                                       -0.07355 \
                                        0.00000  0.00209 \
                                        0.08902  0.00000  0.07146
multipole    205    204    202          0.06931 \
                                        0.03490  0.00000  0.14233 \
                                       -0.05085 \
                                        0.00000 -0.10572 \
                                       -0.03686  0.00000  0.15657
multipole    206    208    202         -0.14395 \
                                        0.16557  0.00000  0.06166 \
                                       -0.06305 \
                                        0.00000 -0.14995 \
                                       -0.12323  0.00000  0.21300
multipole    207    206    208          0.10674 \
                                       -0.00429  0.00000  0.17162 \
                                       -0.00087 \
                                        0.00000 -0.10613 \
                                        0.05594  0.00000  0.10700
multipole    208    206    209         -0.14964 \
                                        0.00176  0.00000  0.05906 \
                                       -0.06180 \
                                        0.00000 -0.04998 \
                                        0.05205  0.00000  0.11178
multipole    209    208    206          0.04988 \
                                        0.04036  0.00000  0.15279 \
                                       -0.04562 \
                                        0.00000 -0.11014 \
                                       -0.01658  0.00000  0.15576
multipole    210    211                 0.45374 \
                                        0.00000  0.00000  0.17403 \
                                        0.02679 \
                                        0.00000  0.02679 \
                                        0.00000  0.00000 -0.05358
multipole    211    210                -0.55384 \
                                        0.00000  0.00000 -0.27340 \
                                        0.23632 \
                                        0.00000  0.23632 \
                                        0.00000  0.00000 -0.47264
multipole    212    210                 0.10010 \
                                        0.00000  0.00000 -0.24877 \
                                        0.13147 \
                                        0.00000  0.13147 \
                                        0.00000  0.00000 -0.26294
multipole    213    214                 0.50893 \
                                        0.00000  0.00000  0.00838 \
                                        0.04512 \
                                        0.00000  0.04512 \
                                        0.00000  0.00000 -0.09024
multipole    214    213                -0.64934 \
                                        0.00000  0.00000 -0.41663 \
                                        0.40285 \
                                        0.00000  0.40285 \
                                        0.00000  0.00000 -0.80570
multipole    215    213                -0.16118 \
                                        0.00000  0.00000  0.17034 \
                                       -0.03526 \
                                        0.00000 -0.03526 \
                                        0.00000  0.00000  0.07052
multipole    216    215    213          0.10053 \
                                        0.00543  0.00000 -0.12249 \
                                        0.11906 \
                                        0.00000  0.00913 \
                                        0.02813  0.00000 -0.12819
multipole    217    219    217          0.04926 \
                                        0.00000  0.00000  0.09671 \
                                       -0.44194 \
                                        0.00000 -0.79642 \
                                        0.00000  0.00000  1.23836
multipole    218    217                -0.33505 \
                                        0.00000  0.00000  0.64421 \
                                       -0.23824 \
                                        0.00000 -0.23824 \
                                        0.00000  0.00000  0.47648
multipole    219    217    217         -0.14263 \
                                        0.00000  0.00000  0.00000 \
                                        0.79947 \
                                        0.00000 -1.59894 \
                                        0.00000  0.00000  0.79947
multipole    220   -220   -220         -0.08620 \
                                        0.00000  0.00000  0.13272 \
                                        0.52524 \
                                        0.00000 -1.18532 \
                                        0.00000  0.00000  0.66008
multipole    221    220    220          0.08620 \
                                        0.00000  0.00000  0.13804 \
                                       -0.01682 \
                                        0.00000 -0.15371 \
                                        0.00000  0.00000  0.17053
multipole    222    229    223          0.03072 \
                                        0.00125  0.00000  0.12469 \
                                       -0.06402 \
                                        0.00000 -0.27768 \
                                       -0.00103  0.00000  0.34170
multipole    223    222    224         -0.12168 \
                                        0.22018  0.00000  0.11136 \
                                        0.29801 \
                                        0.00000 -0.22028 \
                                        0.13973  0.00000 -0.07773
multipole    224    223    225         -0.13553 \
                                        0.08555  0.00000  0.06669 \
                                       -0.05093 \
                                        0.00000 -0.05737 \
                                       -0.14891  0.00000  0.10830
multipole    225    224    224         -0.13956 \
                                        0.09435  0.00000  0.05497 \
                                       -0.05052 \
                                        0.00000 -0.07647 \
                                       -0.15630  0.00000  0.12699
multipole    226    223    222          0.11676 \
                                       -0.00544  0.00000 -0.09789 \
                                       -0.00311 \
                                        0.00000 -0.00530 \
                                        0.00156  0.00000  0.00841
multipole    227    224    223          0.12064 \
                                        0.00158  0.00000 -0.09651 \
                                        0.00420 \
                                        0.00000 -0.00600 \
                                        0.00018  0.00000  0.00180
multipole    228    225    224          0.12262 \
                                        0.00000  0.00000 -0.09664 \
                                        0.00381 \
                                        0.00000 -0.00617 \
                                        0.00001  0.00000  0.00236
multipole    229    222    231         -0.33768 \
                                        0.28850  0.00000  0.23637 \
                                        0.34911 \
                                        0.00000 -0.68326 \
                                       -0.15432  0.00000  0.33415
multipole    230    229    222          0.17341 \
                                        0.00352  0.00000 -0.00147 \
                                       -0.01537 \
                                        0.00000 -0.02747 \
                                        0.00752  0.00000  0.04284
multipole    231    229    232         -0.48745 \
                                        0.00104  0.00000  0.34794 \
                                       -0.36178 \
                                        0.00000 -0.28743 \
                                        0.06023  0.00000  0.64921
multipole    232    231    229          0.16805 \
                                        0.01766  0.00000 -0.02781 \
                                       -0.01320 \
                                        0.00000 -0.02932 \
                                        0.01136  0.00000  0.04252
multipole    233    235    234         -0.60669 \
                                        0.25004  0.00000  0.31054 \
                                        0.14285 \
                                        0.00000 -0.56484 \
                                        0.08761  0.00000  0.42199
multipole    234    233    235          0.37742 \
                                       -0.15154  0.00000  0.12482 \
                                       -0.16870 \
                                        0.00000 -0.06439 \
                                       -0.05778  0.00000  0.23309
multipole    235    233    234          0.35048 \
                                       -0.18052  0.00000  0.28488 \
                                       -0.04061 \
                                        0.00000 -0.91018 \
                                       -0.10133  0.00000  0.95079
multipole    236    235    237         -0.16487 \
                                       -0.12931  0.00000 -0.04059 \
                                        0.25079 \
                                        0.00000 -0.74230 \
                                       -0.03793  0.00000  0.49151
multipole    237   -236   -238          0.05310 \
                                        0.00000  0.00000  0.08000 \
                                        0.19556 \
                                        0.00000 -0.68026 \
                                       -0.32207  0.00000  0.48470
multipole    238   -237   -237         -0.08153 \
                                        0.00000  0.00000  0.00302 \
                                       -0.01236 \
                                        0.00000 -0.60883 \
                                       -0.03456  0.00000  0.62119
multipole    239    236    235          0.03926 \
                                        0.01720  0.00000 -0.00573 \
                                       -0.01641 \
                                        0.00000 -0.08767 \
                                        0.00931  0.00000  0.10408
multipole    240    237    236          0.03581 \
                                        0.04577  0.00000  0.00787 \
                                       -0.05397 \
                                        0.00000 -0.07608 \
                                        0.03840  0.00000  0.13005
multipole    241    238    237          0.03372 \
                                        0.00334  0.00000  0.01200 \
                                       -0.04259 \
                                        0.00000 -0.08852 \
                                       -0.00007  0.00000  0.13111
multipole    242    244    243         -0.15936 \
                                        0.00000  0.00000  0.17072 \
                                       -0.16041 \
                                        0.00000 -0.16041 \
                                        0.00000  0.00000  0.32082
multipole    243    242    244          0.07101 \
                                        0.02604  0.00000 -0.07852 \
                                        0.06399 \
                                        0.00000 -0.00135 \
                                        0.01071  0.00000 -0.06264
multipole    244   -245   -245         -0.04642 \
                                        0.00000  0.00000 -0.05822 \
                                        0.16134 \
                                        0.00000 -0.26055 \
                                       -0.02115  0.00000  0.09921
multipole    245   -244   -246          0.04308 \
                                       -0.03476  0.00000  0.15673 \
                                        0.00214 \
                                        0.00000 -0.48756 \
                                        0.06534  0.00000  0.48542
multipole    246   -247   -245         -0.03035 \
                                        0.02088  0.00000 -0.07104 \
                                        0.32973 \
                                        0.00000 -0.33538 \
                                       -0.03788  0.00000  0.00565
multipole    247   -246   -246         -0.03295 \
                                        0.00000  0.00000 -0.04604 \
                                        0.25750 \
                                        0.00000 -0.32503 \
                                        0.00000  0.00000  0.06753
multipole    248    245    244         -0.00539 \
                                        0.00087  0.00000 -0.13040 \
                                        0.06646 \
                                        0.00000 -0.01180 \
                                        0.00651  0.00000 -0.05466
multipole    249    246    245          0.00351 \
                                        0.00395  0.00000 -0.12499 \
                                        0.04823 \
                                        0.00000 -0.03089 \
                                        0.00000  0.00000 -0.01734
multipole    250    247    246          0.00400 \
                                        0.00000  0.00000 -0.11767 \
                                        0.05367 \
                                        0.00000 -0.04960 \
                                        0.00000  0.00000 -0.00407
multipole    251    258    252         -0.61500 \
                                        0.20835  0.00000  0.36077 \
                                        0.06711 \
                                        0.00000 -0.54881 \
                                        0.08087  0.00000  0.48170
multipole    252    251    258          0.37682 \
                                       -0.18948  0.00000  0.10490 \
                                       -0.18861 \
                                        0.00000 -0.03668 \
                                       -0.09567  0.00000  0.22529
multipole    253    255    254         -0.08979 \
                                       -0.02031  0.00000  0.18981 \
                                       -0.15326 \
                                        0.00000 -0.14641 \
                                       -0.03012  0.00000  0.29967
multipole    254    253    255          0.04735 \
                                        0.01648  0.00000 -0.02086 \
                                       -0.00436 \
                                        0.00000 -0.06126 \
                                        0.01451  0.00000  0.06562
multipole    255   -256   -256         -0.07125 \
                                        0.00000  0.00000 -0.09346 \
                                       -0.28590 \
                                        0.00000 -0.31283 \
                                       -0.15734  0.00000  0.59873
multipole    256   -255   -257          0.05669 \
                                        0.00000  0.00000  0.07425 \
                                        0.19135 \
                                        0.00000 -0.71537 \
                                        0.81888  0.00000  0.52402
multipole    257    258    256         -0.16275 \
                                       -0.13693  0.00000 -0.08748 \
                                        0.24073 \
                                        0.00000 -0.87144 \
                                       -0.09255  0.00000  0.63071
multipole    258    251    252          0.35041 \
                                       -0.17499  0.00000  0.28203 \
                                       -0.06360 \
                                        0.00000 -0.99813 \
                                        0.12021  0.00000  1.06173
multipole    259    256    255          0.02291 \
                                       -0.11444  0.00000  0.00444 \
                                       -0.04484 \
                                        0.00000 -0.07496 \
                                       -0.08873  0.00000  0.11980
multipole    260    257    256          0.03653 \
                                       -0.03274  0.00000  0.00320 \
                                       -0.02466 \
                                        0.00000 -0.09300 \
                                       -0.02348  0.00000  0.11766
multipole    261    263    268          0.20401 \
                                        0.55110  0.00000  0.16949 \
                                        1.40903 \
                                        0.00000 -1.21521 \
                                        0.78253  0.00000 -0.19382
multipole    262    261    263          0.04290 \
                                        0.00000  0.00000 -0.28505 \
                                        0.08538 \
                                        0.00000  0.01295 \
                                        0.00497  0.00000 -0.09833
multipole    263    261    265          0.35555 \
                                        0.52610  0.00000  0.13591 \
                                        0.06732 \
                                        0.00000 -0.52680 \
                                       -0.33777  0.00000  0.45948
multipole    264    263    265          0.08711 \
                                        0.01834  0.00000 -0.17930 \
                                        0.04096 \
                                        0.00000  0.00418 \
                                        0.00934  0.00000 -0.04514
multipole    265    263    266         -0.33192 \
                                        0.68769  0.00000  0.17557 \
                                        0.46425 \
                                        0.00000 -0.27707 \
                                       -0.13096  0.00000 -0.18718
multipole    266    265    268         -0.14311 \
                                       -0.17200 -0.00011 -0.15840 \
                                        0.35808 \
                                        0.00000 -0.08018 \
                                       -0.59259  0.00000 -0.27790
multipole    267    266    268          0.00836 \
                                       -0.01874  0.00000 -0.24808 \
                                        0.07031 \
                                        0.00000  0.03601 \
                                       -0.01152  0.00000 -0.10632
multipole    268    261    266         -0.33219 \
                                       -0.25202  0.00000  0.13585 \
                                       -0.39588 \
                                        0.00000 -0.33590 \
                                       -0.48999  0.00000  0.73178
multipole    269    268    266          0.10929 \
                                        0.01897  0.00000 -0.16645 \
                                        0.02818 \
                                        0.00000  0.00282 \
                                        0.01569  0.00000 -0.03100
multipole    270    282    272         -0.08880 \
                                        0.15672  0.00000  0.31130 \
                                        0.22550 \
                                        0.00000 -0.54417 \
                                       -0.04357  0.00000  0.31867
multipole    271    270    272          0.10822 \
                                        0.02459  0.00000 -0.07191 \
                                        0.00262 \
                                        0.00000 -0.01821 \
                                        0.00804  0.00000  0.01559
multipole    272    270    282         -0.19864 \
                                        0.06214  0.00000  0.22704 \
                                       -0.31471 \
                                        0.00000 -0.11680 \
                                       -0.05010  0.00000  0.43151
multipole    273    272    270          0.08043 \
                                        0.02130  0.00000 -0.09095 \
                                       -0.00575 \
                                        0.00000 -0.01678 \
                                        0.00762  0.00000  0.02253
multipole    274    276    282         -0.12987 \
                                        0.03834  0.00000 -0.06383 \
                                        0.44552 \
                                        0.00000 -0.65766 \
                                        0.40880  0.00000  0.21214
multipole    275    274    282          0.14705 \
                                        0.00425  0.00000 -0.23584 \
                                        0.02977 \
                                        0.00000  0.02206 \
                                        0.00518  0.00000 -0.05183
multipole    276    278    274          0.41790 \
                                        0.31085  0.00000  0.22290 \
                                        0.05430 \
                                        0.00000 -0.25793 \
                                       -0.23315  0.00000  0.20363
multipole    277    276    274          0.09985 \
                                        0.00180  0.00000 -0.21845 \
                                        0.03729 \
                                        0.00000  0.02534 \
                                        0.00058  0.00000 -0.06263
multipole    278    276    280         -0.11640 \
                                        0.03616  0.00000 -0.09843 \
                                        0.51526 \
                                        0.00000 -0.58535 \
                                        0.26527  0.00000  0.07009
multipole    279    278    280          0.14883 \
                                        0.00731  0.00000 -0.23413 \
                                        0.03803 \
                                        0.00000  0.02230 \
                                        0.00516  0.00000 -0.06033
multipole    280    278    282          0.05480 \
                                       -0.12804  0.00000  0.24168 \
                                       -0.44188 \
                                        0.00000 -0.20380 \
                                        0.01046  0.00000  0.64568
multipole    281    280    282          0.08285 \
                                        0.00846  0.00000 -0.21673 \
                                        0.03054 \
                                        0.00012  0.02442 \
                                        0.00333 -0.00018 -0.05496
multipole    282    280    274          0.12470 \
                                        0.11648  0.00000 -0.22490 \
                                        0.55064 \
                                        0.00000 -0.31799 \
                                       -0.10188  0.00000 -0.23265
multipole    283    285    292         -0.10971 \
                                        0.04983  0.00000  0.22870 \
                                        0.42557 \
                                        0.00000 -0.91481 \
                                        0.81241  0.00000  0.48924
multipole    284    283    292          0.08652 \
                                       -0.00346  0.00000 -0.22097 \
                                        0.02323 \
                                        0.00000  0.01497 \
                                        0.00096  0.00000 -0.03820
multipole    285    283    286          0.12507 \
                                        0.05779  0.00000  0.35513 \
                                       -0.13962 \
                                        0.00000 -0.46271 \
                                        0.15746  0.00000  0.60233
multipole    286    285    291         -0.14474 \
                                       -0.06204  0.00000 -0.03779 \
                                        0.15000 \
                                        0.00000 -0.23905 \
                                        0.18939  0.00000  0.08905
multipole    287    291    288         -0.10590 \
                                       -0.07239  0.00000 -0.15945 \
                                        0.16811 \
                                        0.00008  0.08601 \
                                       -0.02311  0.00000 -0.25412
multipole    288    287    289          0.06829 \
                                        0.28429  0.00000  0.11920 \
                                        0.55043 \
                                        0.00000 -0.51069 \
                                        0.42363  0.00000 -0.03974
multipole    289    288    290         -0.04665 \
                                       -0.02624  0.00000  0.01259 \
                                        0.05707 \
                                        0.00000 -0.18029 \
                                       -0.11281  0.00000  0.12322
multipole    290    292    289         -0.10330 \
                                       -0.08090  0.00000 -0.07863 \
                                        0.05342 \
                                        0.00000 -0.02406 \
                                       -0.05229  0.00000 -0.02936
multipole    291    286    292         -0.02981 \
                                       -0.12262  0.00000  0.04028 \
                                        0.18403 \
                                        0.00000 -0.14808 \
                                        0.17023  0.00000 -0.03595
multipole    292    283    291          0.22912 \
                                       -0.01112  0.00000 -0.00350 \
                                       -0.50740 \
                                        0.00007 -0.70671 \
                                       -0.09817  0.00004  1.21411
multipole    293    285    286          0.02522 \
                                        0.00961  0.00000 -0.19443 \
                                        0.02801 \
                                        0.00000  0.01404 \
                                        0.00733  0.00000 -0.04205
multipole    294    286    291          0.00472 \
                                        0.00794  0.00000 -0.20459 \
                                        0.02913 \
                                        0.00000  0.02224 \
                                        0.01030  0.00000 -0.05137
multipole    295    287    288         -0.00669 \
                                        0.00390  0.00000 -0.19154 \
                                        0.02589 \
                                        0.00000  0.01733 \
                                        0.00004  0.00000 -0.04322
multipole    296    288    289          0.00213 \
                                       -0.00328  0.00000 -0.18010 \
                                        0.02710 \
                                        0.00000  0.00837 \
                                       -0.00305  0.00000 -0.03547
multipole    297    289    290          0.00299 \
                                        0.00077  0.00001 -0.18002 \
                                        0.02705 \
                                        0.00000  0.00804 \
                                        0.00100  0.00000 -0.03509
multipole    298    290    289          0.00274 \
                                        0.01150  0.00000 -0.18274 \
                                        0.02088 \
                                        0.00000  0.01393 \
                                        0.00556  0.00000 -0.03481
multipole    299    301    307         -0.05207 \
                                        0.12708  0.00000  0.30461 \
                                        0.51487 \
                                        0.00000 -1.03191 \
                                        0.99253  0.00000  0.51704
multipole    300    299    301          0.08064 \
                                        0.00294  0.00000 -0.22349 \
                                        0.02393 \
                                        0.00000  0.01197 \
                                       -0.00105  0.00000 -0.03590
multipole    301    299    302          0.13685 \
                                        0.07298  0.00000  0.42844 \
                                       -0.00583 \
                                        0.00000 -0.53665 \
                                        0.44410  0.00000  0.54248
multipole    302    301    308         -0.15430 \
                                       -0.31678  0.00000 -0.17576 \
                                        0.03495 \
                                        0.00000 -0.16816 \
                                        0.46592  0.00000  0.13321
multipole    303    304    308         -0.17594 \
                                       -0.32728  0.00000  0.10264 \
                                       -0.33730 \
                                        0.00000  0.25185 \
                                        0.41510  0.00000  0.08545
multipole    304    303    305         -0.00504 \
                                        0.08002  0.00000  0.01285 \
                                        0.19466 \
                                        0.00000 -0.27554 \
                                        0.05597  0.00000  0.08088
multipole    305    304    306          0.04799 \
                                        0.15354  0.00000  0.12274 \
                                        0.39808 \
                                        0.00000 -0.40924 \
                                        0.27737  0.00000  0.01116
multipole    306    305    307         -0.09861 \
                                       -0.12330  0.00000 -0.02034 \
                                       -0.05105 \
                                        0.00000 -0.02710 \
                                        0.04040  0.00000  0.07815
multipole    307    299    306          0.27603 \
                                       -0.03708  0.00000  0.10586 \
                                       -0.40205 \
                                        0.00000 -0.75526 \
                                       -0.21214  0.00000  1.15731
multipole    308    302    303         -0.00524 \
                                        0.24654  0.00000 -0.13229 \
                                        0.14792 \
                                        0.00000 -0.04375 \
                                       -0.13945  0.00000 -0.10417
multipole    309    301    299          0.01133 \
                                       -0.01101  0.00000 -0.20742 \
                                        0.02681 \
                                        0.00000  0.01883 \
                                       -0.01044  0.00000 -0.04564
multipole    310    303    304         -0.01588 \
                                        0.00406  0.00000 -0.20022 \
                                        0.03446 \
                                        0.00000 -0.00468 \
                                        0.00261  0.00000 -0.02978
multipole    311    304    303         -0.00347 \
                                        0.00344  0.00000 -0.18481 \
                                        0.02834 \
                                        0.00000  0.00877 \
                                        0.00321  0.00000 -0.03711
multipole    312    305    304         -0.00474 \
                                       -0.00036  0.00000 -0.18495 \
                                        0.02870 \
                                        0.00000  0.00866 \
                                       -0.00087  0.00000 -0.03736
multipole    313    306    305         -0.00318 \
                                        0.00974  0.00000 -0.18655 \
                                        0.02342 \
                                        0.00000  0.01336 \
                                        0.00229  0.00000 -0.03678
multipole    314    316    302         -0.17670 \
                                       -0.03221  0.00000  0.13464 \
                                       -0.23859 \
                                        0.00000 -0.22495 \
                                        0.14777  0.00000  0.46354
multipole    315    314    302          0.06763 \
                                        0.01091  0.00000 -0.05795 \
                                       -0.00546 \
                                        0.00000 -0.01685 \
                                        0.00682  0.00000  0.02231
multipole    316    314    317         -0.17176 \
                                        0.01465  0.00000  0.14482 \
                                       -0.22206 \
                                        0.00000 -0.17168 \
                                        0.06871  0.00000  0.39374
multipole    317    316    314          0.05961 \
                                        0.01793  0.00000 -0.09695 \
                                        0.00132 \
                                        0.00000 -0.02366 \
                                        0.00756  0.00000  0.02234
multipole    318    320    326         -0.34013 \
                                        0.48521  0.00000  0.42107 \
                                        0.38065 \
                                        0.00000 -0.90200 \
                                        0.57132  0.00000  0.52135
multipole    319    318    320          0.36903 \
                                        0.00295  0.00000 -0.04986 \
                                       -0.00811 \
                                        0.00000 -0.00143 \
                                        0.00173  0.00000  0.00954
multipole    320    318    321          0.05501 \
                                        0.05932  0.00000  0.35325 \
                                       -0.29521 \
                                        0.00000 -0.38209 \
                                       -0.06382  0.00000  0.67730
multipole    321    320    327         -0.17824 \
                                        0.13669  0.00000 -0.00640 \
                                       -0.26881 \
                                        0.00000 -0.11674 \
                                        0.25457  0.00000  0.38555
multipole    322    323    327         -0.15513 \
                                       -0.10798  0.00000  0.03778 \
                                       -0.31271 \
                                        0.00000  0.18975 \
                                        0.01944  0.00000  0.12296
multipole    323    322    324         -0.04396 \
                                        0.11398  0.00000  0.07385 \
                                        0.07401 \
                                        0.00000 -0.22656 \
                                       -0.06641  0.00000  0.15255
multipole    324    323    325         -0.07791 \
                                        0.02176  0.00000  0.02355 \
                                       -0.03649 \
                                        0.00000 -0.07312 \
                                       -0.22343  0.00000  0.10961
multipole    325    324    326         -0.13725 \
                                       -0.03060  0.00000 -0.00278 \
                                       -0.04499 \
                                        0.00000 -0.01141 \
                                       -0.17084  0.00000  0.05640
multipole    326    318    325          0.29737 \
                                       -0.00949  0.00000 -0.31549 \
                                       -0.94644 \
                                        0.00000 -1.04582 \
                                        0.44720  0.00000  1.99226
multipole    327    321    322         -0.05438 \
                                        0.13187  0.00000 -0.03232 \
                                        0.30602 \
                                        0.00000 -0.00200 \
                                        0.05118  0.00000 -0.30402
multipole    328    320    318          0.08202 \
                                        0.00030  0.00000 -0.17548 \
                                        0.03614 \
                                        0.00000  0.03931 \
                                        0.00226  0.00000 -0.07545
multipole    329    322    327          0.07271 \
                                        0.00365  0.00000 -0.17332 \
                                        0.04281 \
                                        0.00000  0.03393 \
                                        0.00107  0.00000 -0.07674
multipole    330    323    324          0.04407 \
                                       -0.00064  0.00000 -0.16646 \
                                        0.04222 \
                                        0.00000  0.03302 \
                                       -0.00015  0.00000 -0.07524
multipole    331    324    325          0.04260 \
                                       -0.00047  0.00000 -0.16643 \
                                        0.04227 \
                                        0.00000  0.03310 \
                                       -0.00014  0.00000 -0.07537
multipole    332    325    326          0.04544 \
                                       -0.00629  0.00000 -0.16669 \
                                        0.03235 \
                                        0.00000  0.03842 \
                                       -0.00279  0.00000 -0.07077
multipole    333    334    321          0.68296 \
                                        0.09638  0.00038  0.34533 \
                                       -0.33906 \
                                       -0.00116 -0.23145 \
                                        0.17792  0.00032  0.57051
multipole    334    333    321         -0.64204 \
                                       -0.13596  0.00000 -0.03726 \
                                       -0.71286 \
                                        0.00000  0.41482 \
                                       -0.24172  0.00000  0.29804
multipole    335    333    334         -0.06217 \
                                        0.00976  0.00000 -0.15720 \
                                        0.04404 \
                                        0.00000  0.03288 \
                                        0.00320  0.00000 -0.07692
multipole    336    338    337         -0.20566 \
                                        0.00836  0.00000  0.11713 \
                                        0.44050 \
                                        0.00000 -1.36729 \
                                       -0.03427  0.00000  0.92679
multipole    337    336    338          0.25307 \
                                        0.02830  0.00000  0.06289 \
                                       -0.01360 \
                                        0.00000 -0.12859 \
                                        0.00625  0.00000  0.14219
multipole    338   -336   -336          0.15996 \
                                        0.00000  0.00000  0.02424 \
                                        0.39018 \
                                        0.00000 -0.79214 \
                                        0.00000  0.00000  0.40196
multipole    339    338    340         -0.08387 \
                                        0.00000  0.00000 -0.01676 \
                                        0.47376 \
                                        0.00000 -1.29130 \
                                        0.00000  0.00000  0.81754
multipole    340   -341   -339         -0.09524 \
                                        0.03212  0.00000  0.20067 \
                                        0.67177 \
                                        0.00000 -1.18961 \
                                        0.03229  0.00000  0.51784
multipole    341   -340   -342         -0.07039 \
                                        0.00000  0.00000  0.16226 \
                                        0.51509 \
                                        0.00000 -1.05821 \
                                        0.00000  0.00000  0.54312
multipole    342   -341   -341         -0.06499 \
                                        0.00000  0.00000  0.15549 \
                                        0.50678 \
                                        0.00000 -1.03720 \
                                        0.00000  0.00000  0.53042
multipole    343    340    341          0.14638 \
                                       -0.01944  0.00000  0.13578 \
                                        0.02066 \
                                        0.00000 -0.13729 \
                                        0.01944  0.00000  0.11663
multipole    344    341    340          0.14253 \
                                        0.00000  0.00000  0.13208 \
                                       -0.01770 \
                                        0.00000 -0.12726 \
                                        0.00000  0.00000  0.14496
multipole    345    342    341          0.14138 \
                                        0.00000  0.00000  0.13189 \
                                       -0.01988 \
                                        0.00000 -0.12630 \
                                        0.00000  0.00000  0.14618
multipole    346   -347   -347         -0.05502 \
                                        0.00000  0.00000  0.06242 \
                                        0.47168 \
                                        0.00000 -1.01871 \
                                        0.00000  0.00000  0.54703
multipole    347    346    348          0.05590 \
                                        0.08253  0.00000  0.13200 \
                                        0.46183 \
                                        0.00000 -0.87034 \
                                        0.01814  0.00000  0.40851
multipole    348    347    349         -0.01443 \
                                        0.07830  0.00000  0.05860 \
                                        0.48262 \
                                        0.00000 -0.93236 \
                                        0.02953  0.00000  0.44974
multipole    349   -348   -348          0.00018 \
                                        0.00000  0.00000  0.08868 \
                                        0.41966 \
                                        0.00000 -0.89464 \
                                        0.00000  0.00000  0.47498
multipole    350    346    347          0.25368 \
                                        0.00000  0.00000  0.04333 \
                                       -0.02775 \
                                        0.00000 -0.11523 \
                                        0.00000  0.00000  0.14298
multipole    351    347    346          0.14841 \
                                       -0.00208  0.00000  0.08930 \
                                       -0.03100 \
                                        0.00000 -0.13300 \
                                        0.00598  0.00000  0.16400
multipole    352    348    347          0.14173 \
                                       -0.00147  0.00000  0.09438 \
                                       -0.03561 \
                                        0.00000 -0.13066 \
                                        0.00307  0.00000  0.16627
multipole    353    349    348          0.13794 \
                                        0.00000  0.00000  0.09607 \
                                       -0.03544 \
                                        0.00000 -0.12801 \
                                        0.00000  0.00000  0.16345

opbend     36     92      0      0   14.40
opbend     39     92      0      0   14.40
opbend     43     56      0      0   42.40
opbend     43     59      0      0   12.90
opbend     43     65      0      0   42.40
opbend     43     92      0      0   14.40
opbend     56     59      0      0   12.90
opbend     56     97      0      0   14.40
opbend     57     56      0      0  140.30
opbend     58     56      0      0   46.80
opbend     58     65      0      0   46.80
opbend     59     56      0      0  107.90
opbend     60     59      0      0    5.80
opbend     63     65      0      0  107.90
opbend     66     56      0      0  140.30
opbend     66     65      0      0  140.30
opbend     87     89      0      0   14.40
opbend     90     90      0      0   14.40
opbend     90    103      0      0   10.80
opbend     91     90      0      0   15.10
opbend     91     97      0      0    7.90
opbend     92     92      0      0   14.40
opbend     92    102      0      0    1.40
opbend     93     92      0      0   15.10
opbend     94     97      0      0   14.40
opbend     97     56      0      0   42.40
opbend     97     97      0      0   14.40
opbend     98     97      0      0   14.40
opbend     99     56      0      0   46.80
opbend    100    102      0      0    1.40
opbend    101    100      0      0   12.90
opbend    102     92      0      0    7.20
opbend    102    100      0      0    3.60
opbend    103     90      0      0   18.00
opbend    104    103      0      0   10.80

pitors     56     59  6.85
pitors     90     90  6.85
pitors     92     92  6.85

polarize      1   0.20500  0.39000
polarize      2   0.39500  0.39000
polarize      3   1.64000  0.39000
polarize      4   2.48000  0.39000
polarize      5   4.04000  0.39000
polarize      6   0.02800  0.39000
polarize      7   0.12000  0.39000
polarize      8   0.78000  0.39000
polarize      9   1.35000  0.39000
polarize     10   2.26000  0.39000
polarize     11   0.01000  0.06500
polarize     12   0.08000  0.11500
polarize     13   0.55000  0.18000
polarize     14   0.82000  0.16500
polarize     15   1.51000  0.30000
polarize     16   0.26000  0.20960
polarize     17   1.35000  0.39000
polarize     18   4.00000  0.39000
polarize     19   5.65000  0.39000
polarize     20   7.25000  0.39000
polarize     21   1.34400  0.39000     22
polarize     22   1.07300  0.39000     21
polarize     23   1.60000  0.39000     24
polarize     24   0.60000  0.39000     23
polarize     25   1.82800  0.39000     26
polarize     26   0.60000  0.39000     25
polarize     27   1.07300  0.39000     27
polarize     28   1.33400  0.39000     29
polarize     29   0.49600  0.39000     28
polarize     30   1.33400  0.39000     31
polarize     31   0.49600  0.39000     30
polarize     32   1.33400  0.39000     33
polarize     33   0.49600  0.39000     32
polarize     34   1.33400  0.39000     35
polarize     35   0.49600  0.39000     34
polarize     36   1.33400  0.39000     37
polarize     37   0.49600  0.39000     36
polarize     38   1.33400  0.39000
polarize     39   0.83700  0.39000     40
polarize     40   0.49600  0.39000     39
polarize     41   0.83700  0.39000     42     43
polarize     42   0.49600  0.39000     41
polarize     43   1.33400  0.39000     41     44
polarize     44   0.49600  0.39000     43
polarize     45   0.83400  0.39000     46     47     51
polarize     46   0.49600  0.39000     45
polarize     47   1.33400  0.39000     45     48
polarize     48   0.49600  0.39000     47
polarize     49   1.33400  0.39000     50
polarize     50   0.49600  0.39000     49
polarize     51   1.33400  0.39000     45     52
polarize     52   0.49600  0.39000     51
polarize     53   1.33400  0.39000     54
polarize     54   0.49600  0.39000     53
polarize     55   0.83400  0.39000     56     57
polarize     56   0.49600  0.39000     55
polarize     57   1.33400  0.39000     55     58
polarize     58   0.49600  0.39000     57
polarize     59   1.33400  0.39000     60
polarize     60   0.49600  0.39000     59
polarize     61   0.83700  0.39000     62
polarize     62   1.33400  0.39000     61     63
polarize     63   0.49600  0.39000     62
polarize     64   1.07300  0.39000     65
polarize     65   0.49600  0.39000     64
polarize     66   1.07300  0.39000     67
polarize     67   0.49600  0.39000     66
polarize     68   1.07300  0.39000     69     70
polarize     69   0.49600  0.39000     68
polarize     70   1.33400  0.39000     68     71
polarize     71   0.49600  0.39000     70
polarize     72   1.07300  0.39000     73     74
polarize     73   0.49600  0.39000     72
polarize     74   1.33400  0.39000     72     75
polarize     75   0.49600  0.39000     74
polarize     76   1.33400  0.39000     77
polarize     77   0.49600  0.39000     76
polarize     78   1.33400  0.39000     79
polarize     79   0.49600  0.39000     78
polarize     80   1.33400  0.39000     81
polarize     81   0.49600  0.39000     80
polarize     82   1.07300  0.39000     83     84
polarize     83   0.49600  0.39000     82
polarize     84   1.33400  0.39000     82     85
polarize     85   0.49600  0.39000     84
polarize     86   1.07300  0.39000     87
polarize     87   1.33400  0.39000     86     88
polarize     88   0.49600  0.39000     87
polarize     89   1.07300  0.39000     90
polarize     90   0.49600  0.39000     89
polarize     91   1.33400  0.39000     92
polarize     92   0.49600  0.39000     91
polarize     93   1.33400  0.39000     94
polarize     94   0.49600  0.39000     93
polarize     95   1.07300  0.39000     96    100
polarize     96   1.33400  0.39000     95     97
polarize     97   0.49600  0.39000     96
polarize     98   1.33400  0.39000     99
polarize     99   0.49600  0.39000     98
polarize    100   1.33400  0.39000     95    101
polarize    101   0.49600  0.39000    100
polarize    102   1.33400  0.39000    103    104    105
polarize    103   0.49600  0.39000    102
polarize    104   0.83700  0.39000    102
polarize    105   1.07300  0.39000    102    106
polarize    106   0.49600  0.39000    105
polarize    107   1.33400  0.39000    108    109
polarize    108   0.83700  0.39000    107
polarize    109   1.07300  0.39000    107    110
polarize    110   0.49600  0.39000    109
polarize    111   1.33400  0.39000    112
polarize    112   0.49600  0.39000    111
polarize    113   1.33400  0.39000    114
polarize    114   0.49600  0.39000    113
polarize    115   1.33400  0.39000    116
polarize    116   0.49600  0.39000    115
polarize    117   1.33400  0.39000    118    119    120
polarize    118   0.49600  0.39000    117
polarize    119   0.83700  0.39000    117
polarize    120   1.07300  0.39000    117    121
polarize    121   0.49600  0.39000    120
polarize    122   1.33400  0.39000    123
polarize    123   0.49600  0.39000    122    124
polarize    124   1.33400  0.39000    123
polarize    125   1.33400  0.39000    126
polarize    126   0.49600  0.39000    125
polarize    127   1.33400  0.39000    128    129
polarize    128   0.83700  0.39000    127
polarize    129   1.07300  0.39000    127    130
polarize    130   0.49600  0.39000    129
polarize    131   1.33400  0.39000    132
polarize    132   0.49600  0.39000    131
polarize    133   1.33400  0.39000    134
polarize    134   0.49600  0.39000    133
polarize    135   1.33400  0.39000    136    137    138
polarize    136   0.49600  0.39000    135
polarize    137   0.83700  0.39000    135
polarize    138   1.07300  0.39000    135
polarize    139   1.33400  0.39000    140
polarize    140   0.49600  0.39000    139
polarize    141   1.33400  0.39000    142    143
polarize    142   0.83700  0.39000    141
polarize    143   1.07300  0.39000    141
polarize    144   1.33400  0.39000    145
polarize    145   0.49600  0.39000    144
polarize    146   1.33400  0.39000    147
polarize    147   0.49600  0.39000    146
polarize    148   0.83700  0.39000    149    150
polarize    149   0.49600  0.39000    148
polarize    150   1.33400  0.39000    148    151    152
polarize    151   0.83700  0.39000    150
polarize    152   0.49600  0.39000    150
polarize    153   0.83700  0.39000    154    155
polarize    154   0.49600  0.39000    153
polarize    155   1.33400  0.39000    153    156
polarize    156   0.83700  0.39000    155
polarize    157   1.33400  0.39000    158
polarize    158   0.49600  0.39000    157
polarize    159   1.33400  0.39000    160    161
polarize    160   0.83700  0.39000    159
polarize    161   0.49600  0.39000    159
polarize    162   1.33400  0.39000    163    166
polarize    163   0.83700  0.39000    162
polarize    164   1.33400  0.39000    165
polarize    165   0.49600  0.39000    164
polarize    166   0.49600  0.39000    162
polarize    167   2.80000  0.39000    168
polarize    168   0.49600  0.39000    167
polarize    169   2.80000  0.39000    170    171
polarize    170   0.49600  0.39000    169
polarize    171   1.33400  0.39000    169    172
polarize    172   0.49600  0.39000    171
polarize    173   2.80000  0.39000    174
polarize    174   1.33400  0.39000    173    175
polarize    175   0.49600  0.39000    174
polarize    176   2.80000  0.39000    176    177
polarize    177   1.33400  0.39000    176    178
polarize    178   0.49600  0.39000    177
polarize    179   2.80000  0.39000    180    181
polarize    180   0.49600  0.39000    179
polarize    181   1.33400  0.39000    179    182
polarize    182   0.49600  0.39000    181
polarize    183   1.33400  0.39000    184
polarize    184   0.49600  0.39000    183
polarize    185   2.80000  0.39000    186    188
polarize    186   1.33400  0.39000    185    187
polarize    187   0.49600  0.39000    186
polarize    188   1.33400  0.39000    185    189
polarize    189   0.49600  0.39000    188
polarize    190   1.33400  0.39000    191
polarize    191   0.49600  0.39000    190
polarize    192   3.30000  0.39000    193    194
polarize    193   0.83700  0.39000    192
polarize    194   1.33400  0.39000    192    195
polarize    195   0.49600  0.39000    194
polarize    196   3.30000  0.39000    199
polarize    197   0.83700  0.39000    198
polarize    198   1.33400  0.39000    197
polarize    199   0.49600  0.39000    196
polarize    200   3.30000  0.39000    201
polarize    201   0.83700  0.39000    200
polarize    202   1.33400  0.39000    203
polarize    203   0.49600  0.39000    202
polarize    204   1.33400  0.39000    205
polarize    205   0.49600  0.39000    204
polarize    206   1.33400  0.39000    207
polarize    207   0.49600  0.39000    206
polarize    208   1.33400  0.39000    209
polarize    209   0.49600  0.39000    208
polarize    210   1.07300  0.39000    211
polarize    211   1.33400  0.39000    210    212
polarize    212   0.49600  0.39000    211
polarize    213   1.33400  0.39000    214    215
polarize    214   1.07300  0.39000    213
polarize    215   1.33400  0.39000    213    216
polarize    216   0.49600  0.39000    215
polarize    217   1.33400  0.39000    218    219
polarize    218   1.07300  0.39000    217
polarize    219   1.33400  0.39000    217
polarize    220   1.75000  0.39000    220    221
polarize    221   0.69600  0.39000    220
polarize    222   1.75000  0.39000    223
polarize    223   1.75000  0.39000    222    224    226
polarize    224   1.75000  0.39000    223    225    227
polarize    225   1.75000  0.39000    224    228
polarize    226   0.69600  0.39000    223
polarize    227   0.69600  0.39000    224
polarize    228   0.69600  0.39000    225
polarize    229   1.33400  0.39000    230
polarize    230   0.49600  0.39000    229
polarize    231   1.33400  0.39000    232
polarize    232   0.49600  0.39000    231
polarize    233   0.83700  0.39000    234    235
polarize    234   0.49600  0.39000    233
polarize    235   1.75000  0.39000    233    236
polarize    236   1.75000  0.39000    235    237    239
polarize    237   1.75000  0.39000    236    238    240
polarize    238   1.75000  0.39000    237    241
polarize    239   0.69600  0.39000    236
polarize    240   0.69600  0.39000    237
polarize    241   0.69600  0.39000    238
polarize    242   1.33400  0.39000    243
polarize    243   0.49600  0.39000    242
polarize    244   1.75000  0.39000    245
polarize    245   1.75000  0.39000    244    246    248
polarize    246   1.75000  0.39000    245    247    249
polarize    247   1.75000  0.39000    246    250
polarize    248   0.69600  0.39000    245
polarize    249   0.69600  0.39000    246
polarize    250   0.69600  0.39000    247
polarize    251   0.87300  0.39000    252    258
polarize    252   0.49600  0.39000    251
polarize    253   1.33400  0.39000    254    255
polarize    254   0.49600  0.39000    253
polarize    255   1.75000  0.39000    253    256
polarize    256   1.75000  0.39000    255    257    259
polarize    257   1.75000  0.39000    256    258    260
polarize    258   1.75000  0.39000    251    257
polarize    259   0.69600  0.39000    256
polarize    260   0.69600  0.39000    257
polarize    261   1.07300  0.39000    262    263    268
polarize    262   0.49600  0.39000    261
polarize    263   1.33400  0.39000    261    264    265
polarize    264   0.49600  0.39000    263
polarize    265   1.07300  0.39000    263    266
polarize    266   1.33400  0.39000    265    267    268
polarize    267   0.49600  0.39000    266
polarize    268   1.33400  0.39000    261    266    269
polarize    269   0.49600  0.39000    268
polarize    270   1.37700  0.39000    271
polarize    271   0.49600  0.39000    270
polarize    272   1.33700  0.39000    273
polarize    273   0.49600  0.39000    272
polarize    274   1.07300  0.39000    275    276    282
polarize    275   0.49600  0.39000    274
polarize    276   1.33400  0.39000    274    277    278
polarize    277   0.49600  0.39000    276
polarize    278   1.07300  0.39000    276    279    280
polarize    279   0.49600  0.39000    278
polarize    280   1.33400  0.39000    278    281    282
polarize    281   0.49600  0.39000    280
polarize    282   1.33400  0.39000    274    280
polarize    283   1.07300  0.39000    284    285    292
polarize    284   0.49600  0.39000    283
polarize    285   1.33400  0.39000    283    286    293
polarize    286   1.33400  0.39000    285    291    294
polarize    287   1.33400  0.39000    288    291    295
polarize    288   1.33400  0.39000    287    289    296
polarize    289   1.33400  0.39000    288    290    297
polarize    290   1.33400  0.39000    289    292    298
polarize    291   1.33400  0.39000    286    287    292
polarize    292   1.33400  0.39000    283    290    291
polarize    293   0.49600  0.39000    285
polarize    294   0.49600  0.39000    286
polarize    295   0.49600  0.39000    287
polarize    296   0.49600  0.39000    288
polarize    297   0.49600  0.39000    289
polarize    298   0.49600  0.39000    290
polarize    299   1.07300  0.39000    300    301    307
polarize    300   0.49600  0.39000    299
polarize    301   1.33400  0.39000    299    302    309
polarize    302   1.33400  0.39000    301    308
polarize    303   1.33400  0.39000    304    308    310
polarize    304   1.33400  0.39000    303    305    311
polarize    305   1.33400  0.39000    304    306    312
polarize    306   1.33400  0.39000    305    307    313
polarize    307   1.33400  0.39000    299    306    308
polarize    308   1.33400  0.39000    302    303    307
polarize    309   0.49600  0.39000    301
polarize    310   0.49600  0.39000    303
polarize    311   0.49600  0.39000    304
polarize    312   0.49600  0.39000    305
polarize    313   0.49600  0.39000    306
polarize    314   1.33400  0.39000    315
polarize    315   0.49600  0.39000    314
polarize    316   1.33400  0.39000    317
polarize    317   0.49600  0.39000    316
polarize    318   1.07300  0.39000    319    320    326
polarize    319   0.49600  0.39000    318
polarize    320   1.33400  0.39000    318    321    328
polarize    321   1.33400  0.39000    320    327    333
polarize    322   1.33400  0.39000    323    327    329
polarize    323   1.33400  0.39000    322    324    330
polarize    324   1.33400  0.39000    323    325    331
polarize    325   1.33400  0.39000    324    326    332
polarize    326   1.33400  0.39000    318    325    327
polarize    327   1.33400  0.39000    321    322    326
polarize    328   0.49600  0.39000    320
polarize    329   0.49600  0.39000    322
polarize    330   0.49600  0.39000    323
polarize    331   0.49600  0.39000    324
polarize    332   0.49600  0.39000    325
polarize    333   1.33400  0.39000    321    334    335
polarize    334   0.83700  0.39000    333
polarize    335   0.49600  0.39000    333
polarize    336   1.07300  0.39000    337    338
polarize    337   0.49600  0.39000    336
polarize    338   0.49600  0.39000    336    339
polarize    339   1.75000  0.39000    338    340
polarize    340   1.75000  0.39000    339    341    343
polarize    341   1.75000  0.39000    340    342    344
polarize    342   1.75000  0.39000    341    345
polarize    343   0.69600  0.39000    340
polarize    344   0.69600  0.39000    341
polarize    345   0.69600  0.39000    342
polarize    346   1.07300  0.39000    347    350
polarize    347   1.75000  0.39000    346    348    351
polarize    348   1.75000  0.39000    347    349    352
polarize    349   1.75000  0.39000    348    353
polarize    350   0.49600  0.39000    346
polarize    351   0.69600  0.39000    347
polarize    352   0.69600  0.39000    348
polarize    353   0.69600  0.39000    349

strbnd     30     30     31   11.50   11.50
strbnd     31     30     32   11.50   11.50
strbnd     31     30     34   11.50   11.50
strbnd     30     32     30   18.70   18.70
strbnd     30     32     32   18.70   18.70
strbnd     30     32     33   11.50   11.50
strbnd     32     32     32   18.70   18.70
strbnd     32     32     33   11.50   11.50
strbnd     30     34     30   18.70   18.70
strbnd     30     34     32   18.70   18.70
strbnd     30     34     35   11.50   11.50
strbnd     32     34     32   18.70   18.70
strbnd     32     34     35   11.50   11.50
strbnd     40     39     41   -4.50   38.00
strbnd     40     39     43   -4.50   38.00
strbnd     40     39     92   12.95   12.95
strbnd     43     39     43   38.00   38.00
strbnd     39     41     42   38.00   -4.50
strbnd     39     43     42   38.00   -4.50
strbnd     39     43     43   38.00   38.00
strbnd     39     43     44   11.50   11.50
strbnd     39     43     47   38.00   -4.50
strbnd     42     43     43   -4.50   38.00
strbnd     43     43     43   18.70   18.70
strbnd     43     43     44   38.00   -4.50
strbnd     43     43     45   38.00   -4.50
strbnd     43     43     52   18.70   18.70
strbnd     43     43     54   11.50   11.50
strbnd     43     43     55   11.50   11.50
strbnd     43     43     56   18.70   18.70
strbnd     43     43     59   18.70   18.70
strbnd     43     43     61   11.50   11.50
strbnd     43     43     62   11.50   11.50
strbnd     43     43     79   18.70   18.70
strbnd     43     43     81   11.50   11.50
strbnd     43     43     92   18.70   18.70
strbnd     43     43     95   18.70   18.70
strbnd     44     43     46   11.50   11.50
strbnd     44     43     52   11.50   11.50
strbnd     44     43     92   11.50   11.50
strbnd     44     43     95   11.50   11.50
strbnd     45     43     52   11.50   11.50
strbnd     45     43     56   11.50   11.50
strbnd     52     43     54   11.50   11.50
strbnd     52     43     55   11.50   11.50
strbnd     54     43     92   11.50   11.50
strbnd     56     43     61   11.50   11.50
strbnd     59     43     62   11.50   11.50
strbnd     65     43     67   11.50   11.50
strbnd     79     43     81   11.50   11.50
strbnd     39     46     42   38.00   -4.50
strbnd     39     46     43   38.00   38.00
strbnd     42     46     43   -4.50   38.00
strbnd     43     46     43   38.00   38.00
strbnd      0     52     43    4.30    4.30
strbnd     43     52     43    7.20    7.20
strbnd     43     52     53    4.30    4.30
strbnd     43     56     58   18.70   18.70
strbnd     43     56     59   18.70   18.70
strbnd     57     56     58   11.50   11.50
strbnd     57     56     59   11.50   11.50
strbnd     58     56     59   18.70   18.70
strbnd     66     56     97   11.50   11.50
strbnd     66     56     99   11.50   11.50
strbnd     97     56     99   18.70   18.70
strbnd     43     59     43    7.20    7.20
strbnd     43     59     56    7.20    7.20
strbnd     43     59     60    4.30    4.30
strbnd     56     59     60    4.30    4.30
strbnd     64     63     65   12.95   12.95
strbnd     43     65     58   18.70   18.70
strbnd     43     65     63   18.70   18.70
strbnd     43     65     66   11.50   11.50
strbnd     58     65     63   18.70   18.70
strbnd     58     65     66   11.50   11.50
strbnd     63     65     66   11.50   11.50
strbnd     70     65     72   11.50   11.50
strbnd     70     65     73   18.70   18.70
strbnd     72     65     73   11.50   11.50
strbnd     65     70     65   -5.75   -5.75
strbnd     65     70     70   -5.75   -5.75
strbnd     65     70     71    1.45    1.45
strbnd     65     73     74   11.50   11.50
strbnd     76     75     77   -5.75   -5.75
strbnd     77     75     77   -5.75   -5.75
strbnd     75     77     78   11.50   11.50
strbnd     83     82     85   18.70   18.70
strbnd     82     85     86   11.50   11.50
strbnd     88     87     89   18.70   18.70
strbnd     87     89     87   18.70   18.70
strbnd     90     90     90   18.70   18.70
strbnd     90     90     91   11.50   11.50
strbnd     90     90    103   18.70   18.70
strbnd     91     90    103   11.50   11.50
strbnd     39     92     92   18.70   18.70
strbnd     43     92     92   18.70   18.70
strbnd     92     92     92   18.70   18.70
strbnd     92     92     93   38.00   11.60
strbnd     92     92    102   18.70   18.70
strbnd      0     94     98    4.30    4.30
strbnd     49     94     95    4.30    4.30
strbnd     49     94     97    4.30    4.30
strbnd     49     94     98    4.30    4.30
strbnd     95     94     95   14.40   14.40
strbnd     97     94     97   14.40   14.40
strbnd     43     95     94   18.70   18.70
strbnd     43     95     95   18.70   18.70
strbnd     94     95     94   18.70   18.70
strbnd     94     95     95   18.70   18.70
strbnd     94     95     96   11.50   11.50
strbnd     95     95     96   11.50   11.50
strbnd     56     97     97   18.70   18.70
strbnd     91     97     94   11.50   11.50
strbnd     91     97     97   11.50   11.50
strbnd     94     97     97   18.70   18.70
strbnd     97     97     97   18.70   18.70
strbnd     97     97     98   18.70   18.70

torsion    42     0    52    53  -0.014 180.000 2   0.295   0.000 3
torsion    31    30    30    31   0.299   0.000 3
torsion    31    30    32    30   0.341   0.000 3
torsion    31    30    32    32   0.341   0.000 3
torsion    31    30    32    33   0.299   0.000 3
torsion    30    32    32    30   0.854   0.000 1  -0.374 180.000 2   0.108   0.000 3
torsion    30    32    32    32   0.854   0.000 1  -0.374 180.000 2   0.108   0.000 3
torsion    30    32    32    33   0.341   0.000 3
torsion    32    32    32    32   0.854   0.000 1  -0.374 180.000 2   0.108   0.000 3
torsion    32    32    32    33   0.108   0.000 3
torsion    33    32    32    33   0.299   0.000 3
torsion    40    39    41    42   0.274   0.000 3
torsion    40    39    43    42   0.274   0.000 3
torsion    40    39    43    43  -1.447   0.000 1   0.531 180.000 2   0.317   0.000 3
torsion    43    39    43    47   0.597   0.000 3
torsion    40    39    46    42   0.266   0.000 3
torsion    40    39    46    43  -1.372   0.000 1   0.232 180.000 2   0.400   0.000 3
torsion    40    39    92    92   2.081 180.000 2
torsion    39    43    43    43  -1.150   0.000 1   1.280   0.000 3
torsion    39    43    43    44   0.300   0.000 3
torsion    39    43    43    45   0.300   0.000 3
torsion    42    43    43    43   0.280   0.000 3
torsion    42    43    43    44   0.424   0.000 3
torsion    42    43    43    45   0.238   0.000 3
torsion    43    43    43    43   0.185   0.000 1   0.170 180.000 2   0.520   0.000 3
torsion    43    43    43    44   0.280   0.000 3
torsion    43    43    43    52  -0.302   0.000 1   0.696 180.000 2   0.499   0.000 3
torsion    43    43    43    54   0.280   0.000 3
torsion    43    43    43    55   0.299   0.000 3
torsion    43    43    43    79   0.280   0.000 3
torsion    43    43    43    81   0.280   0.000 3
torsion    44    43    43    44   0.299   0.000 3
torsion    44    43    43    45   0.238   0.000 3
torsion    44    43    43    52   0.374   0.000 3
torsion    44    43    43    54   0.299   0.000 3
torsion    44    43    43    59   0.500   0.000 3
torsion    44    43    43    62   0.299   0.000 3
torsion    44    43    43    79   0.238   0.000 3
torsion    44    43    43    81   0.299   0.000 3
torsion    44    43    43    92   0.500   0.000 3
torsion    44    43    43    95   0.500   0.000 3
torsion    45    43    43    52   0.374   0.000 3
torsion    45    43    43    54   0.238   0.000 3
torsion    45    43    43    79   0.238   0.000 3
torsion    45    43    43    81   0.299   0.000 3
torsion    52    43    43    55   0.374   0.000 3
torsion    55    43    43    55   0.299   0.000 3
torsion    44    43    46    39   0.300   0.000 3
torsion    44    43    46    42   0.238   0.000 3
torsion    44    43    46    43   0.280   0.000 3
torsion    43    43    52    43   0.958   0.000 1  -0.155 180.000 2   0.766   0.000 3
torsion    43    43    52    53  -0.107   0.000 1   0.512 180.000 2   0.365   0.000 3
torsion    45    43    52    43   0.072   0.000 1  -0.012 180.000 2   0.563   0.000 3
torsion    54    43    52    43   0.072   0.000 1  -0.012 180.000 2   0.563   0.000 3
torsion    54    43    52    53   0.661 180.000 2   0.288   0.000 3
torsion    55    43    52    43   0.121   0.000 1  -0.648 180.000 2   0.199   0.000 3
torsion    55    43    52    53   0.121   0.000 1  -0.648 180.000 2   0.199   0.000 3
torsion    61    43    56    58   0.235   0.000 3
torsion    61    43    56    59  -0.010   0.000 3
torsion    43    43    59    56   0.660   0.000 1  -0.456 180.000 2   0.254   0.000 3
torsion    43    43    59    60  -0.660   0.000 1  -0.420 180.000 2  -0.254   0.000 3
torsion    62    43    59    43   0.460   0.000 3
torsion    62    43    59    56  -0.126   0.000 3
torsion    62    43    59    60   0.000   0.000 1
torsion    67    43    65    58  -0.154   0.000 1   0.044 180.000 2  -0.086   0.000 3
torsion    67    43    65    63   0.250   0.000 1   0.850 180.000 2
torsion    67    43    65    66   0.115   0.000 1   0.027 180.000 2   0.285   0.000 3
torsion    43    43    79    80   0.000   0.000 1
torsion    81    43    79    80   0.000   0.000 1
torsion    43    43    92    92  -0.800   0.000 1  -0.100 180.000 2  -0.550   0.000 3
torsion    44    43    92    92  -0.090   0.000 3
torsion    54    43    92    92  -0.090   0.000 3
torsion    43    43    95    94  -0.800   0.000 1  -0.100 180.000 2  -0.550   0.000 3
torsion    43    43    95    95  -0.800   0.000 1  -0.100 180.000 2  -0.550   0.000 3
torsion    44    43    95    94   0.299   0.000 3
torsion    44    43    95    95   0.299   0.000 3
torsion    43    56    59    43  -1.000   0.000 1   2.000 180.000 2   2.050   0.000 3
torsion    43    56    59    60   1.200 180.000 2   0.800   0.000 3
torsion    57    56    59    43   2.250 180.000 2
torsion    57    56    59    60   0.500 180.000 2   0.350   0.000 3
torsion    58    56    59    43   1.000   0.000 1   2.250 180.000 2  -2.250   0.000 3
torsion    58    56    59    60  -0.664 180.000 2  -0.357   0.000 3
torsion    66    56    97    97  -0.300   0.000 1   8.000 180.000 2
torsion    99    56    97    97   8.000 180.000 2
torsion    64    63    65    43   5.390 180.000 2   1.230   0.000 3
torsion    64    63    65    58  -1.200   0.000 1   5.390 180.000 2   0.400   0.000 3
torsion    64    63    65    66  -0.300   0.000 1   5.390 180.000 2
torsion    72    65    70    65   0.660   0.000 3
torsion    72    65    70    71   0.383   0.000 3
torsion    73    65    70    65  -0.440   0.000 1  -0.260 180.000 2   0.600   0.000 3
torsion    73    65    70    71  -1.096   0.000 1   0.079 180.000 2   0.384   0.000 3
torsion    70    65    73    74   0.475   0.000 3
torsion    72    65    73    74   0.238   0.000 3
torsion    76    75    77    78   0.500   0.000 3
torsion    77    75    77    78   0.500   0.000 3
torsion    83    82    85    86   0.000   0.000 1
torsion    88    87    89    87   0.000   0.000 1
torsion    90    90    90    90  -0.670   0.000 1   4.004 180.000 2
torsion    90    90    90    91   0.550   0.000 1   4.534 180.000 2  -0.550   0.000 3
torsion    90    90    90   103   5.470 180.000 2
torsion    91    90    90    91   4.072 180.000 2
torsion    91    90    90   103  -3.150   0.000 1   3.000 180.000 2
torsion    90    90   103    90  14.000 180.000 2
torsion    90    90   103   104  -3.150   0.000 1   8.000 180.000 2
torsion    91    90   103    90  -6.650   0.000 1  20.000 180.000 2
torsion    91    90   103   104  -0.530   0.000 1   3.000 180.000 2
torsion    39    92    92    92   4.470 180.000 2
torsion    39    92    92    93   4.470 180.000 2
torsion    43    92    92    92  -0.610   0.000 1   4.212 180.000 2
torsion    43    92    92    93   6.104 180.000 2
torsion    92    92    92    92  -0.670   0.000 1   4.004 180.000 2
torsion    92    92    92    93   0.550   0.000 1   4.534 180.000 2  -0.550   0.000 3
torsion    92    92    92   102  -0.610   0.000 1   4.212 180.000 2
torsion    93    92    92    93   4.072 180.000 2
torsion    93    92    92   102   6.104 180.000 2
torsion    92    92   102   100   2.304 180.000 2
torsion    49    94    95    43   4.104 180.000 2
torsion    49    94    95    94  -2.744   0.000 1  15.000 180.000 2
torsion    49    94    95    95  -3.150   0.000 1   8.000 180.000 2
torsion    49    94    95    96  -0.530   0.000 1   3.000 180.000 2
torsion    95    94    95    43   4.212 180.000 2
torsion    95    94    95    94  15.000 180.000 2
torsion    95    94    95    95  14.000 180.000 2
torsion    95    94    95    96   7.000 180.000 2
torsion    49    94    97    91  -0.530   0.000 1   3.000 180.000 2
torsion    49    94    97    97  -3.150   0.000 1   8.000 180.000 2
torsion    97    94    97    91  -6.650   0.000 1  20.000 180.000 2
torsion    97    94    97    97  14.000 180.000 2
torsion    43    95    95    94   4.212 180.000 2
torsion    43    95    95    96   4.102 180.000 2
torsion    94    95    95    94   0.900   0.000 1  15.000 180.000 2
torsion    94    95    95    96  -3.150   0.000 1   3.000 180.000 2
torsion    96    95    95    96  11.500 180.000 2
torsion    56    97    97    91   6.104 180.000 2
torsion    56    97    97    94   5.470 180.000 2
torsion    56    97    97    97  -0.610   0.000 1   4.212 180.000 2
torsion    91    97    97    91   7.072 180.000 2
torsion    91    97    97    94  -3.150   0.000 1   3.000 180.000 2
torsion    91    97    97    97   0.250   0.000 1   5.534 180.000 2  -0.550   0.000 3
torsion    91    97    97    98   6.104 180.000 2
torsion    94    97    97    97   5.470 180.000 2
torsion    94    97    97    98   5.470 180.000 2
torsion    97    97    97    97  -0.670   0.000 1   4.304 180.000 2
torsion    97    97    97    98  -0.610   0.000 1   4.212 180.000 2
torsion    97    97    98    44   0.341   0.000 3
torsion    97    97    98    98   0.260   0.000 1  -0.255 180.000 2   0.260   0.000 3
torsion    44    98    98    44   0.299   0.000 3
torsion    44    98    98    97   0.341   0.000 3
torsion   101   100   102    92   4.000 180.000 2
torsion   101   100   102   100   4.000 180.000 2

ureybrad     38     37     38   -7.60   1.5337

vdw      0  0.000000000  0.000000000
vdw      1  2.990000000  0.008000000
vdw      2  3.150000000  0.073000000
vdw      3  3.820000000  0.260000000
vdw      4  4.090000000  0.359000000
vdw      5  4.370000000  0.498000000
vdw      6  2.200000000  0.066000000
vdw      7  2.955000000  0.280000000
vdw      8  3.680000000  0.350000000
vdw      9  3.900000000  0.380000000
vdw     10  4.140000000  0.420000000
vdw     11  1.880000000  0.091000000
vdw     12  2.900000000  0.280000000
vdw     13  3.590000000  0.350000000
vdw     14  3.870000000  0.385000000
vdw     15  4.200000000  0.420000000
vdw     16  2.680000000  0.222000000
vdw     17  3.430000000  0.250000000
vdw     18  4.120000000  0.340000000
vdw     19  4.320000000  0.430000000
vdw     20  4.610000000  0.520000000
vdw     21  4.120000000  0.101000000
vdw     22  3.710000000  0.110000000
vdw     23  3.900000000  0.100000000
vdw     24  3.220000000  0.120000000
vdw     25  4.530000000  0.350000000
vdw     26  3.220000000  0.120000000
vdw     27  3.710000000  0.080000000  0.990
vdw     28  3.780000000  0.101000000
vdw     29  2.900000000  0.022000000  0.900
vdw     30  3.820000000  0.101000000
vdw     31  2.960000000  0.024000000  0.920
vdw     32  3.820000000  0.101000000
vdw     33  2.980000000  0.024000000  0.940
vdw     34  3.650000000  0.101000000
vdw     35  2.940000000  0.026000000  0.910
vdw     36  3.600000000  0.104000000
vdw     37  3.405000000  0.110000000
vdw     38  2.655000000  0.013500000  0.910
vdw     39  3.405000000  0.110000000
vdw     40  2.655000000  0.013500000  0.910
vdw     41  3.760000000  0.101000000
vdw     42  2.870000000  0.024000000  0.910
vdw     43  3.820000000  0.101000000
vdw     44  2.960000000  0.024000000  0.920
vdw     45  2.980000000  0.024000000  0.920
vdw     46  3.650000000  0.101000000
vdw     47  2.890000000  0.024000000  0.910
vdw     48  3.710000000  0.105000000
vdw     49  2.700000000  0.020000000  0.910
vdw     50  3.710000000  0.105000000
vdw     51  2.480000000  0.011500000  0.900
vdw     52  3.710000000  0.105000000
vdw     53  2.700000000  0.020000000  0.910
vdw     54  2.880000000  0.024000000  0.910
vdw     55  2.960000000  0.022000000  0.920
vdw     56  3.820000000  0.106000000
vdw     57  2.800000000  0.026000000  0.910
vdw     58  3.300000000  0.112000000
vdw     59  3.710000000  0.110000000
vdw     60  2.590000000  0.022000000  0.900
vdw     61  2.950000000  0.026000000  0.910
vdw     62  2.930000000  0.026000000  0.910
vdw     63  3.405000000  0.110000000
vdw     64  2.655000000  0.015000000  0.910
vdw     65  3.780000000  0.106000000
vdw     66  2.920000000  0.030000000  0.920
vdw     67  2.980000000  0.024000000  0.940
vdw     68  4.005000000  0.355000000
vdw     69  2.770000000  0.024000000  0.960
vdw     70  4.005000000  0.355000000
vdw     71  2.770000000  0.024000000  0.960
vdw     72  2.870000000  0.033000000  0.900
vdw     73  3.820000000  0.104000000
vdw     74  2.980000000  0.024000000  0.920
vdw     75  3.910000000  0.385000000
vdw     76  3.520000000  0.112000000
vdw     77  3.820000000  0.101000000
vdw     78  2.910000000  0.024500000  0.910
vdw     79  3.910000000  0.385000000
vdw     80  3.510000000  0.112000000
vdw     81  2.910000000  0.033000000  0.900
vdw     82  3.820000000  0.101000000
vdw     83  3.580000000  0.110000000
vdw     84  2.920000000  0.030000000  0.920
vdw     85  3.820000000  0.101000000
vdw     86  2.910000000  0.033000000  0.900
vdw     87  3.820000000  0.106000000
vdw     88  3.690000000  0.110000000
vdw     89  3.820000000  0.106000000
vdw     90  3.800000000  0.089000000
vdw     91  2.980000000  0.026000000  0.920
vdw     92  3.800000000  0.091000000
vdw     93  2.980000000  0.026000000  0.920
vdw     94  3.710000000  0.105000000
vdw     95  3.780000000  0.101000000
vdw     96  3.000000000  0.024000000  0.940
vdw     97  3.800000000  0.101000000
vdw     98  3.820000000  0.104000000
vdw     99  3.300000000  0.114000000
vdw    100  3.710000000  0.110000000
vdw    101  2.590000000  0.022000000  0.900
vdw    102  3.650000000  0.101000000
vdw    103  3.710000000  0.105000000
vdw    104  2.700000000  0.020000000  0.910

vdwpr      8     18  4.236000000  0.151200000
vdwpr      8     19  4.379000000  0.166400000
vdwpr      8     20  4.636000000  0.172000000
vdwpr      9     18  4.315000000  0.185900000
vdwpr      9     19  4.448000000  0.206800000
vdwpr      9     20  4.690000000  0.214500000
vdwpr     10     18  4.345000000  0.289400000
vdwpr     10     19  4.475000000  0.330700000
vdwpr     10     20  4.711000000  0.346600000
