* LIGAND DATABASE FILE (OPLS2005)
*
001      64    65    113    176     329
    1     0 S   NP   _N1_     1    28.92807    96.55126   -21.24315
    2     1 S   H    _HN1     2     1.02792    95.66720  -107.89242
    3     1 S   H    _H1_     3     1.02853    77.20806    -0.43521
    4     1 S   H    _H2_     4     1.02959    38.48710   140.48359
    5     1 S   CT   _CA1     5     1.50607   145.20831   108.52375
    6     5 S   HC   _HA1     6     1.09641   104.48558    84.15672
    7     5 S   CO3  _C1_     7     1.54366   110.74287   -31.60279
    8     7 S   O2Z  _O11     8     1.25988   116.77310  -119.26800
    9     7 S   O2Z  _O12     9     1.26598   113.71195    59.55823
   10     5 S   CT   _CB1    10     1.53054   106.90144  -159.99282
   11    10 S   HC   HB11    11     1.09848   109.67962   -42.83666
   12    10 S   HC   HB12    12     1.09784   110.21656    73.67251
   13    10 S   CT   _CG1    13     1.53105   112.73652  -163.50671
   14    13 S   HC   HG11    14     1.09361   110.90895   -61.02216
   15    13 S   HC   HG12    15     1.09655   109.89978    58.14602
   16    13 S   C    _CD1    16     1.51853   111.88668   178.14861
   17    16 S   O    _OE1    17     1.22772   123.09998    -1.35263
   18    16 S   N    _N2_    18     1.38634   112.01285   179.35928
   19    18 S   H    _HN2    19     1.01597   119.09227     0.47724
   20    18 S   CT1  _CA2    20     1.46295   123.12657   178.02622
   21    20 S   HC   _HA2    21     1.09726   109.36850     2.01965
   22    20 S   C    _C2_    22     1.53568   108.70636  -113.64353
   23    22 S   O    _O2_    23     1.23061   122.06944  -146.37533
   24    20 S   CT   _CB2    32     1.53303   111.74934   123.93726
   25    24 S   HC   HB21    33     1.09398   109.77798    60.70388
   26    24 S   HC   HB22    34     1.09547   110.36870   178.26370
   27    22 S   N    _N3_    24     1.38456   113.72177    40.93157
   28    27 S   H    _HN3    25     1.01473   119.03455    -0.47929
   29    24 S   S    _SG2    35     1.82907   111.87766   -62.75266
   30    27 S   CT   _CA3    26     1.45458   123.52083   175.46469
   31    30 S   HC   HA31    27     1.09516   109.37064    22.36380
   32    30 S   HC   HA32    28     1.09502   107.09475   139.35161
   33    29 S   CT   _C14    36     1.84577   100.02291   136.51568
   34    33 S   HC   _H3_    37     1.09634   106.50115    46.48002
   35    30 S   CO3  _C3_    29     1.52901   112.97795  -101.22260
   36    35 S   O2Z  _O31    30     1.26412   115.33638   -47.10735
   37    35 S   O2Z  _O32    31     1.26346   115.03925   133.79944
   38    33 S   CA   _C6_    38     1.52016   111.05113   -72.18095
   39    33 S   CT   _C15    59     1.53563   109.86158   163.84829
   40    39 S   HC   _H13    60     1.09911   109.16663   171.66978
   41    39 S   HC   _H14    61     1.09826   110.97945    55.16604
   42    38 S   CA   _C5_    39     1.40277   119.60465   114.00734
   43    42 S   HA   _H5_    40     1.08768   120.34433     0.94419
   44    39 S   CO3  _C16    62     1.53358   115.80727   -69.69747
   45    44 S   O2Z  _O34    63     1.26199   116.20465   -31.17219
   46    44 S   O2Z  _O33    64     1.26450   114.42486   150.04201
   47    42 S   CA   _C4_    41     1.39645   120.87794  -178.21239
   48    47 S   HA   _H4_    42     1.08730   118.99878   179.05126
   49    47 S   CA   _C9_    43     1.39926   120.53316    -0.50124
   50    49 S   CA   _C8_    44     1.39977   118.83701    -0.43431
   51    50 S   HA   _H7_    45     1.08765   120.37869   179.87967
   52    49 S   CT   _C10    48     1.50381   120.50035   178.17909
   53    52 S   HC   _H8_    49     1.09633   111.69018    18.18077
   54    52 S   HC   _H9_    50     1.09625   110.55667   137.48643
   55    38 S   CA   _C7_    46     1.40271   122.02134   -65.26363
   56    55 S   HA   _H6_    47     1.08742   120.61825    -0.57403
   57    52 S   NA   _N4_    51     1.45187   111.22236  -101.77025
   58    57 S   C5A  _C11    52     1.36562   126.10058  -108.36402
   59    58 S   HA   _H10    53     1.08135   122.89053     1.43217
   60    58 S   C5B  _C12    54     1.37541   104.74598  -178.79325
   61    60 S   HA   _H11    55     1.08047   127.47485  -179.78420
   62    60 S   N5B  _N5_    56     1.37182   111.16281     0.23323
   63    57 S   CRA  _C13    57     1.36719   126.24492    73.91914
   64    63 S   HA   _H12    58     1.08158   122.78744    -1.07647
  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
  14   7   2   1   1  13   7   4   3   8   4   2   1   1   9   3
  10   7   3  10   4   3   1   1   7   6   4   4   2   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    55    39    40    41    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    42    43    47    50    55    56    39    40    41    44    45    46  
   38    42    55    39    40    41    44  
   36    37  
   37  
    0  
   42    43    47    48    49    50    51    55    56    39    40    41    44  
   40    41    44    45    46    42    55  
   41    44    45    46  
   44    45    46  
   43    47    48    49    50    55    56    52  
   47    48    49    55  
   45    46  
   46  
    0  
   48    49    50    51    55    52    53    54    57  
   49    50    52  
   50    51    55    56    52    53    54    57    58    63  
   51    55    56    52    53    54    57  
   55    56    52  
   53    54    57    58    59    60    62    63    64    55  
   54    57    58    63  
   57    58    63  
   56  
    0  
   58    59    60    61    62    63    64  
   59    60    61    62    63    64  
   60    61    62    63  
   61    62    63    64  
   62    63  
   63    64  
   64  
    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  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   2.5000   0.0300   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   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   47   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   48   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   49   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   50   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   51   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   52   3.5000   0.0660   0.117500   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   56   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   57   3.2500   0.1700  -0.073500   1.8000   1.6000   0.001000000  -0.511443539
   58   3.5500   0.0700  -0.286000   2.0020   1.7750   0.001000000  -0.843144165
   59   2.4200   0.0300   0.187000   1.3810   1.2100   0.030040813   0.268726247
   60   3.5500   0.0700   0.185000   2.0020   1.7750   0.001000000  -0.843144165
   61   2.4200   0.0300   0.075000   1.3810   1.2100   0.030040813   0.268726247
   62   3.2500   0.1700  -0.563000   1.8000   1.6000   0.001000000  -0.511443539
   63   3.5500   0.0700   0.275000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.078000   1.3810   1.2100   0.030040813   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    55   469.000  1.400
   42    43   367.000  1.080
   42    47   469.000  1.400
   47    48   367.000  1.080
   47    49   469.000  1.400
   49    50   469.000  1.400
   49    52   317.000  1.510
   50    51   367.000  1.080
   50    55   469.000  1.400
   55    56   367.000  1.080
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    57   320.000  1.443
   57    58   427.000  1.381
   57    63   477.000  1.343
   58    59   367.000  1.080
   58    60   520.000  1.370
   60    61   367.000  1.080
   60    62   410.000  1.394
   62    63   488.000  1.335
   63    64   367.000  1.080
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    44   317.000  1.522
   44    45   656.000  1.250
   44    46   656.000  1.250
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    55    70.00000  120.00000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    44    70.00000  109.69300
   38    33    34    35.00000  109.50000
   38    42    43    35.00000  120.00000
   38    42    47    63.00000  120.00000
   38    55    50    63.00000  120.00000
   38    55    56    35.00000  120.00000
   42    47    48    35.00000  120.00000
   42    47    49    63.00000  120.00000
   47    42    43    35.00000  120.00000
   47    49    50    63.00000  120.00000
   47    49    52    70.00000  120.00000
   49    47    48    35.00000  120.00000
   49    50    51    35.00000  120.00000
   49    50    55    63.00000  120.00000
   49    52    53    35.00000  109.50000
   49    52    54    35.00000  109.50000
   49    52    57    75.00000  110.34000
   50    55    56    35.00000  120.00000
   55    38    42    63.00000  120.00000
   55    50    51    35.00000  120.00000
   52    49    50    70.00000  120.00000
   52    57    58    65.00000  127.50000
   52    57    63    60.00000  127.66100
   54    52    53    33.00000  107.80000
   57    52    53    50.00000  108.61900
   57    52    54    50.00000  108.61900
   57    58    59    35.00000  121.60000
   57    58    60    70.00000  106.30000
   57    63    62    70.00000  120.00000
   57    63    64    35.00000  120.00000
   58    60    61    35.00000  128.20000
   58    60    62    70.00000  111.00000
   60    58    59    35.00000  130.70000
   60    62    63    70.00000  110.00000
   62    60    61    35.00000  120.00000
   62    63    64    35.00000  120.00000
   63    57    58    70.00000  109.80000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.17500
   39    44    45    70.00000  117.00000
   39    44    46    70.00000  117.00000
   41    39    40    33.00000  107.80000
   44    39    40    35.00000  109.50000
   44    39    41    35.00000  109.50000
   46    44    45    80.00000  126.00000
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    55  -0.16000  1.0 1.0
   29    33    38    55  -0.03200 -1.0 2.0
   29    33    38    55   0.04500  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    44   0.56750  1.0 1.0
   29    33    39    44  -0.07550 -1.0 2.0
   29    33    39    44   0.20000  1.0 3.0
   33    38    42    43   3.62500 -1.0 2.0
   33    38    42    47   3.62500 -1.0 2.0
   33    38    55    50   3.62500 -1.0 2.0
   33    38    55    56   3.62500 -1.0 2.0
   33    39    44    45   0.41150 -1.0 2.0
   33    39    44    46   0.41150 -1.0 2.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    38    55   0.00000  1.0 1.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    44  -0.11250  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    33    39    44  -2.95950  1.0 1.0
   38    33    39    44   0.02300  1.0 3.0
   38    42    47    48   3.62500 -1.0 2.0
   38    42    47    49   3.62500 -1.0 2.0
   42    38    55    50   3.62500 -1.0 2.0
   42    38    55    56   3.62500 -1.0 2.0
   42    47   -49    50   3.62500 -1.0 2.0
   42    47    49    52   3.62500 -1.0 2.0
   43    42    47    48   3.62500 -1.0 2.0
   43    42    47    49   3.62500 -1.0 2.0
   47    49    50    51   3.62500 -1.0 2.0
   47    49    50    55   3.62500 -1.0 2.0
   47    49    52    53   0.00000  1.0 1.0
   47    49    52    54   0.00000  1.0 1.0
   47    49    52    57   0.04300 -1.0 2.0
   48    47    49    50   3.62500 -1.0 2.0
   48    47    49    52   3.62500 -1.0 2.0
   49    50   -55    38   3.62500 -1.0 2.0
   49    50    55    56   3.62500 -1.0 2.0
   49    52    57    58   0.68100  1.0 1.0
   49    52    57    58   0.03350 -1.0 2.0
   49    52    57    58   0.36200  1.0 3.0
   49    52    57    63   0.68100  1.0 1.0
   49    52    57    63   0.03350 -1.0 2.0
   49    52    57    63   0.36200  1.0 3.0
   50    49    52    53   0.00000  1.0 1.0
   50    49    52    54   0.00000  1.0 1.0
   50    49    52    57   0.04300 -1.0 2.0
   51    50    55    38   3.62500 -1.0 2.0
   51    50    55    56   3.62500 -1.0 2.0
   55    38    42    43   3.62500 -1.0 2.0
   55    38   -42    47   3.62500 -1.0 2.0
   52    49    50    51   3.62500 -1.0 2.0
   52    49    50    55   3.62500 -1.0 2.0
   52    57    58    59   3.62500 -1.0 2.0
   52    57    58    60   3.62500 -1.0 2.0
   52    57    63    62   3.62500 -1.0 2.0
   52    57    63    64   3.62500 -1.0 2.0
   53    52    57    58   0.00000  1.0 1.0
   53    52    57    63   0.00000  1.0 1.0
   54    52    57    58   0.00000  1.0 1.0
   54    52    57    63   0.00000  1.0 1.0
   57    58    60    61   5.37500 -1.0 2.0
   57    58   -60    62   5.37500 -1.0 2.0
   58    57   -63    62   2.32500 -1.0 2.0
   58    57    63    64   2.32500 -1.0 2.0
   58    60   -62    63   2.40000 -1.0 2.0
   59    58    60    61   3.62500 -1.0 2.0
   59    58    60    62   3.62500 -1.0 2.0
   60    62   -63    57   5.00000 -1.0 2.0
   60    62    63    64   5.00000 -1.0 2.0
   61    60    62    63   2.40000 -1.0 2.0
   63    57    58    59   3.62500 -1.0 2.0
   63    57   -58    60   1.40000 -1.0 2.0
   39    33    38    42   0.04150 -1.0 2.0
   39    33    38    55   0.04150 -1.0 2.0
   40    39    44    45   0.00000  1.0 1.0
   40    39    44    46   0.00000  1.0 1.0
   41    39    44    45   0.00000  1.0 1.0
   41    39    44    46   0.00000  1.0 1.0
IPHI
    8     5     7     9  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
   36    30    35    37  10.50000 -1.0 2.0
   42    55    38    33   4.00000 -1.0 2.0
   47    43    42    38   1.10000 -1.0 2.0
   49    48    47    42   1.10000 -1.0 2.0
   50    52    49    47   4.00000 -1.0 2.0
   55    51    50    49   1.10000 -1.0 2.0
   50    56    55    38   1.10000 -1.0 2.0
   58    63    57    52   4.00000 -1.0 2.0
   60    59    58    57   1.10000 -1.0 2.0
   62    61    60    58   1.10000 -1.0 2.0
   62    64    63    57   1.10000 -1.0 2.0
   45    39    44    46  10.50000 -1.0 2.0
END
