* LIGAND DATABASE FILE (OPLS2005)
*
001      62    65    115    191     339
    1     0 S   NP   _N1_     1    28.58011    95.06847   -22.73904
    2     1 S   H    _HN1     2     1.02779    99.39018   -77.30467
    3     1 S   H    _H1_     3     1.02960    83.14357    30.21341
    4     1 S   H    _H2_     4     1.02837    30.06829   173.06800
    5     1 S   CT   _CA1     5     1.50112   138.13798   143.28816
    6     5 S   HC   _HA1     6     1.09574   105.24216    74.60011
    7     5 S   CO3  _C1_     7     1.53792   112.38475   -45.62912
    8     7 S   O2Z  _O11     8     1.26358   115.01104   -44.28864
    9     7 S   O2Z  _O12     9     1.26240   114.91822   134.91979
   10     5 S   CT   _CB1    10     1.53096   107.43224  -167.48983
   11    10 S   HC   HB11    11     1.09824   109.34937   -50.90792
   12    10 S   HC   HB12    12     1.09821   110.40856    65.64265
   13    10 S   CT   _CG1    13     1.53006   112.66680  -172.02058
   14    13 S   HC   HG11    14     1.09598   110.42600   -63.33760
   15    13 S   HC   HG12    15     1.09648   110.00595    55.88241
   16    13 S   C    _CD1    16     1.51813   112.32243   176.24198
   17    16 S   O    _OE1    17     1.22719   123.26736    -3.02051
   18    16 S   N    _N2_    18     1.38640   111.62329   177.17596
   19    18 S   H    _HN2    19     1.01583   119.01563     1.37601
   20    18 S   CT1  _CA2    20     1.46202   123.38234  -179.70261
   21    20 S   HC   _HA2    21     1.09735   109.38953    -8.32096
   22    20 S   C    _C2_    22     1.53471   108.39770  -123.94213
   23    22 S   O    _O2_    23     1.23021   122.17888  -145.94382
   24    20 S   CT   _CB2    32     1.53452   111.52768   113.69943
   25    24 S   HC   HB21    33     1.09584   109.89080    55.90817
   26    24 S   HC   HB22    34     1.09427   110.03225   174.86309
   27    22 S   N    _N3_    24     1.38484   113.42471    41.37796
   28    27 S   H    _HN3    25     1.01523   118.91858    -0.91064
   29    24 S   S    _SG2    35     1.82764   111.69596   -65.10422
   30    27 S   CT   _CA3    26     1.45473   123.64908   175.23050
   31    30 S   HC   HA31    27     1.09513   109.49314    18.90049
   32    30 S   HC   HA32    28     1.09509   107.05088   135.94214
   33    29 S   CT   _C19    36     1.84371    99.81819   168.79839
   34    33 S   HC   _H3_    37     1.09663   107.91036   -44.77948
   35    30 S   CO3  _C3_    29     1.52925   112.95799  -104.75981
   36    35 S   O2Z  _O31    30     1.26421   115.35002   -45.41801
   37    35 S   O2Z  _O32    31     1.26350   115.01524   135.46653
   38    33 S   CA   _C13    38     1.51633   109.19304  -162.72570
   39    33 S   CT   _C18    60     1.52833   111.66426    74.33734
   40    39 S   HC   _H26    61     1.09484   111.69742   -49.87222
   41    39 S   HC   _H27    62     1.09818   109.99227  -168.11179
   42    38 S   CA   _C7_    39     1.40233   119.65032    84.48330
   43    42 S   HA   _H23    40     1.08757   120.37158     2.80219
   44    42 S   CA   _C6_    41     1.39230   120.52761  -176.31215
   45    44 S   HA   _H22    42     1.08750   118.98956   179.80119
   46    44 S   CA   _C10    43     1.39750   120.15520     0.72091
   47    46 S   CR3  _C8_    44     1.40833   120.28246    -0.65938
   48    46 S   CM   _C14    56     1.46543   120.03692   179.06163
   49    48 S   HC   _H24    57     1.08524   118.45707     0.62338
   50    38 S   CR3  _C9_    45     1.41330   120.29010   -92.22898
   51    50 S   CA   _C12    46     1.40938   122.11597    -4.11223
   52    51 S   CA   _C5_    47     1.39821   121.44410   177.41881
   53    52 S   HA   _H21    48     1.08690   121.13747  -179.97202
   54    51 S   CO4  _C17    58     1.48302   119.30879    -4.95737
   55    54 S   O    _O18    59     1.22605   121.13753   169.17927
   56    52 S   CA   _C4_    49     1.39145   119.76253     1.13038
   57    56 S   HA   _H20    50     1.08686   119.10987   179.56795
   58    47 S   CA   _C11    51     1.40812   121.00548   179.16984
   59    58 S   CO4  _C16    52     1.48368   119.47025     0.22728
   60    59 S   O    _O17    53     1.22460   121.92694  -179.88297
   61    59 S   CM   _C15    54     1.48280   117.43666     0.19077
   62    61 S   HC   _H25    55     1.08393   117.56682   179.77445
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  13   7   2   1   1  14   8   4   3   8   4   8   3  10  12   7
   3   8   7   7   4   2   1   5   2   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    42    50    54    39    40    41  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    42    43    44    47    50    51    54    55    39    40    41  
   38    42    50    54    39    40    41  
   36    37  
   37  
    0  
   42    43    44    45    46    47    50    51    52    58    54    39    40    41  
   40    41    42    50    51    52    54    55  
   41    51    54    55  
   51    54    55  
   43    44    45    46    47    50    51    48  
   44    45    46    50  
   45    46    47    50    58    61    48    49  
   46    47    48  
   47    50    51    56    58    59    61    62    48    49  
   50    51    52    56    57    58    59    60    61    48    49    54  
   49    50    58    59    60    61    62  
   59    61    62  
   51    52    53    56    58    59    54    55  
   52    53    56    57    58    54    55  
   53    56    57    58    59    54    55  
   56    57    58    54  
   55    56  
    0  
   57    58    59    60    61  
   58    59  
   59    60    61    62  
   60    61    62  
   61    62  
   62  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.222500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   42   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   43   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   44   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   45   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   46   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   49   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   51   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   52   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   54   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   55   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   56   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   57   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   58   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   59   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   60   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   61   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   62   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    39   268.000  1.529
   38    42   469.000  1.400
   38    50   490.000  1.398
   42    43   367.000  1.080
   42    44   469.000  1.400
   44    45   367.000  1.080
   44    46   469.000  1.400
   46    47   490.000  1.398
   46    48   320.000  1.460
   47    50   490.000  1.398
   47    58   490.000  1.398
   50    51   490.000  1.398
   51    52   469.000  1.400
   51    54   310.000  1.470
   52    53   367.000  1.080
   52    56   469.000  1.400
   56    57   367.000  1.080
   56    58   469.000  1.400
   58    59   310.000  1.470
   59    60   570.000  1.229
   59    61   320.000  1.462
   61    62   340.000  1.080
   61    48   549.000  1.340
   48    49   340.000  1.080
   54    55   570.000  1.229
   54    39   317.000  1.522
   39    40   340.000  1.090
   39    41   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    80.00000  109.48900
   29    33    39    75.00000  111.63000
   33    38    42    70.00000  120.00000
   33    38    50    80.00000  105.07000
   33    39    54    63.00000  111.10000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   38    33    34    35.00000  109.50000
   38    42    43    35.00000  120.00000
   38    42    44    63.00000  120.00000
   38    50    47    60.00000  130.80000
   38    50    51    60.00000  130.80000
   42    44    45    35.00000  120.00000
   42    44    46    63.00000  120.00000
   44    42    43    35.00000  120.00000
   44    46    47    70.00000  112.88000
   44    46    48    60.00000  120.93500
   46    44    45    35.00000  120.00000
   46    47    50    60.00000  130.80000
   46    47    58    60.00000  130.80000
   46    48    61    60.00000  123.20500
   46    48    49    40.00000  117.26300
   47    50    51    60.00000  130.80000
   47    58    56    70.00000  112.88000
   47    58    59    60.00000  119.52600
   50    38    42    70.00000  112.88000
   50    51    52    70.00000  112.88000
   50    51    54    60.00000  119.52600
   51    52    53    35.00000  120.00000
   51    52    56    63.00000  120.00000
   51    54    55    75.00000  123.78400
   51    54    39    65.00000  115.47100
   52    56    57    35.00000  120.00000
   52    56    58    63.00000  120.00000
   56    52    53    35.00000  120.00000
   56    58    59    60.00000  119.52600
   58    47    50    60.00000  130.80000
   58    56    57    35.00000  120.00000
   58    59    60    75.00000  123.78400
   58    59    61    65.00000  117.02400
   59    61    62    40.00000  117.72500
   59    61    48    65.00000  118.96000
   61    59    60    80.00000  123.72100
   61    48    49    35.00000  120.00000
   48    46    47    60.00000  120.93500
   48    61    62    35.00000  120.00000
   54    51    52    60.00000  119.52600
   54    39    40    35.00000  109.50000
   54    39    41    35.00000  109.50000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.17500
   39    54    55    80.00000  120.40000
   41    39    40    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    42  -0.16000  1.0 1.0
   29    33    38    42  -0.03200 -1.0 2.0
   29    33    38    42   0.04500  1.0 3.0
   29    33    38    50  -0.16000  1.0 1.0
   29    33    38    50  -0.03200 -1.0 2.0
   29    33    38    50   0.04500  1.0 3.0
   29    33    39    54   0.56750  1.0 1.0
   29    33    39    54  -0.07550 -1.0 2.0
   29    33    39    54   0.20000  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   33    38    42    43   3.62500 -1.0 2.0
   33    38    42    44   3.62500 -1.0 2.0
   33    38    50    47   3.62500 -1.0 2.0
   33    38    50    51   3.62500 -1.0 2.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    38    50   0.00000  1.0 1.0
   34    33    39    54  -0.11250  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   38    33    39    54   0.56750  1.0 1.0
   38    33    39    54  -0.07550 -1.0 2.0
   38    33    39    54   0.20000  1.0 3.0
   38    33    39    40   0.43200  1.0 3.0
   38    33    39    41   0.43200  1.0 3.0
   38    42    44    45   3.62500 -1.0 2.0
   38    42    44    46   3.62500 -1.0 2.0
   38    50    51    52   3.62500 -1.0 2.0
   38    50   -51    54   3.62500 -1.0 2.0
   42    38    50    47   3.62500 -1.0 2.0
   42    38    50    51   3.62500 -1.0 2.0
   42    44   -46    47   3.62500 -1.0 2.0
   42    44    46    48   3.62500 -1.0 2.0
   43    42    44    45   3.62500 -1.0 2.0
   43    42    44    46   3.62500 -1.0 2.0
   44    46    47    50   3.62500 -1.0 2.0
   44    46    47    58   3.62500 -1.0 2.0
   44    46    48    61   0.15800  1.0 1.0
   44    46    48    61   1.85350 -1.0 2.0
   44    46    48    61  -0.48700  1.0 3.0
   44    46    48    49   0.56550  1.0 3.0
   45    44    46    47   3.62500 -1.0 2.0
   45    44    46    48   3.62500 -1.0 2.0
   46    47   -50    38   3.62500 -1.0 2.0
   46    47    50    51   3.62500 -1.0 2.0
   46    47    58    56   3.62500 -1.0 2.0
   46    47    58    59   3.62500 -1.0 2.0
   47    46    48    61   0.15800  1.0 1.0
   47    46    48    61   1.85350 -1.0 2.0
   47    46    48    61  -0.48700  1.0 3.0
   47    46    48    49   0.56550  1.0 3.0
   47    50    51    52   3.62500 -1.0 2.0
   47    50    51    54   3.62500 -1.0 2.0
   47    58    59    60   1.05000 -1.0 2.0
   47    58   -59    61  -0.11500  1.0 1.0
   47    58   -59    61   1.10450 -1.0 2.0
   47    58   -59    61  -0.48050  1.0 3.0
   50    38    42    43   3.62500 -1.0 2.0
   50    38   -42    44   3.62500 -1.0 2.0
   50    47    58    56   3.62500 -1.0 2.0
   50    47    58    59   3.62500 -1.0 2.0
   50    51    52    53   3.62500 -1.0 2.0
   50    51   -52    56   3.62500 -1.0 2.0
   50    51    54    55   1.05000 -1.0 2.0
   50    51    54    39   2.26350  1.0 1.0
   50    51    54    39   0.76750 -1.0 2.0
   50    51    54    39   0.22500  1.0 3.0
   51    52    56    57   3.62500 -1.0 2.0
   51    52    56    58   3.62500 -1.0 2.0
   51    54   -39    33   0.05850 -1.0 2.0
   51    54   -39    33   0.17250  1.0 3.0
   51    54    39    40   0.00000  1.0 1.0
   51    54    39    41   0.00000  1.0 1.0
   52    51    54    55   1.05000 -1.0 2.0
   52    51    54    39   2.26350  1.0 1.0
   52    51    54    39   0.76750 -1.0 2.0
   52    51    54    39   0.22500  1.0 3.0
   52    56   -58    47   3.62500 -1.0 2.0
   52    56    58    59   3.62500 -1.0 2.0
   53    52    56    57   3.62500 -1.0 2.0
   53    52    56    58   3.62500 -1.0 2.0
   56    58    59    60   1.05000 -1.0 2.0
   56    58    59    61  -0.11500  1.0 1.0
   56    58    59    61   1.10450 -1.0 2.0
   56    58    59    61  -0.48050  1.0 3.0
   57    56    58    47   3.62500 -1.0 2.0
   57    56    58    59   3.62500 -1.0 2.0
   58    47    50    38   3.62500 -1.0 2.0
   58    47   -50    51   3.62500 -1.0 2.0
   58    59    61    62   1.64500 -1.0 2.0
   58    59    61    48  -1.65800  1.0 1.0
   58    59    61    48   0.77650 -1.0 2.0
   59    61   -48    46   7.00000 -1.0 2.0
   59    61    48    49   7.00000 -1.0 2.0
   60    59    61    62   0.00000  1.0 1.0
   60    59    61    48   1.00000 -1.0 2.0
   62    61    48    46   7.00000 -1.0 2.0
   62    61    48    49   7.00000 -1.0 2.0
   48    46    47    50   3.62500 -1.0 2.0
   48    46   -47    58   3.62500 -1.0 2.0
   54    51    52    53   3.62500 -1.0 2.0
   54    51    52    56   3.62500 -1.0 2.0
   55    54    39    33   0.30150 -1.0 2.0
   55    54    39    40   0.00000  1.0 1.0
   55    54    39    41   0.00000  1.0 1.0
   39    33    38    42   0.04150 -1.0 2.0
   39    33   -38    50   0.04150 -1.0 2.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   37    30    35    36  10.50000 -1.0 2.0
   42    50    38    33   4.00000 -1.0 2.0
   44    43    42    38   1.10000 -1.0 2.0
   46    45    44    42   1.10000 -1.0 2.0
   47    48    46    44   4.00000 -1.0 2.0
   50    58    47    46   4.00000 -1.0 2.0
   47    51    50    38   4.00000 -1.0 2.0
   52    54    51    50   4.00000 -1.0 2.0
   56    53    52    51   1.10000 -1.0 2.0
   58    57    56    52   1.10000 -1.0 2.0
   56    59    58    47   4.00000 -1.0 2.0
   58    61    59    60  10.50000 -1.0 2.0
   59    62    61    48   1.10000 -1.0 2.0
   46    49    48    61   1.10000 -1.0 2.0
   51    39    54    55  10.50000 -1.0 2.0
END
