* LIGAND DATABASE FILE (OPLS2005)
*
001      66    68    114    186     337
    1     0 S   NP   _N1_     1    28.98517    93.24843   -21.04458
    2     1 S   H    _HN1     2     1.02971    28.70128   120.53737
    3     1 S   H    _H1_     3     1.02790    85.04386   -96.60379
    4     1 S   H    _H2_     4     1.02858    99.14052    11.11633
    5     1 S   CT   _CA1     5     1.50554   136.68723   146.10352
    6     5 S   HC   _HA1     6     1.09681   104.63757    50.89795
    7     5 S   CO3  _C1_     7     1.54448   110.84414   -64.93304
    8     7 S   O2Z  _O11     8     1.26087   116.77187  -120.99788
    9     7 S   O2Z  _O12     9     1.26556   113.74028    58.04931
   10     5 S   CT   _CB1    10     1.53068   106.98553   166.99804
   11    10 S   HC   HB11    11     1.09836   109.96872   -42.14058
   12    10 S   HC   HB12    12     1.09794   110.07591    74.44752
   13    10 S   CT   _CG1    13     1.53092   112.53239  -162.83583
   14    13 S   HC   HG11    14     1.09476   110.86785   -54.82386
   15    13 S   HC   HG12    15     1.09634   110.02406    64.18462
   16    13 S   C    _CD1    16     1.51775   111.84070  -175.87156
   17    16 S   O    _OE1    17     1.22756   123.09083   -12.83069
   18    16 S   N    _N2_    18     1.38571   111.85631   167.76231
   19    18 S   H    _HN2    19     1.01587   119.16517     1.83867
   20    18 S   CT1  _CA2    20     1.46253   123.23735  -176.77396
   21    20 S   HC   _HA2    21     1.09722   109.43316    -9.83179
   22    20 S   C    _C2_    22     1.53373   108.61865  -125.75607
   23    22 S   O    _O2_    23     1.23022   122.19471  -146.69450
   24    20 S   CT   _CB2    32     1.53410   111.10982   111.99266
   25    24 S   HC   HB21    33     1.09462   109.36436    58.62074
   26    24 S   HC   HB22    34     1.09516   110.69677   176.74592
   27    22 S   N    _N3_    24     1.38495   113.42622    40.71510
   28    27 S   H    _HN3    25     1.01522   118.89831    -0.64771
   29    24 S   S    _SG2    35     1.83009   111.53822   -63.78204
   30    27 S   CT   _CA3    26     1.45451   123.46814   175.12468
   31    30 S   HC   HA31    27     1.09522   109.25818    24.02287
   32    30 S   HC   HA32    28     1.09496   107.11767   141.02630
   33    29 S   CT   _C10    36     1.83964   100.03246   148.93444
   34    33 S   HC   _H3_    37     1.09723   104.17505    51.31038
   35    30 S   CO3  _C3_    29     1.52921   113.09372   -99.47139
   36    35 S   O2Z  _O31    30     1.26403   115.39212   -44.79475
   37    35 S   O2Z  _O32    31     1.26353   114.99080   136.13410
   38    33 S   CA   _C9_    38     1.52178   113.53347   -66.44347
   39    33 S   C5A  _C11    51     1.49724   110.47791   166.66819
   40    38 S   CA   _C4_    39     1.40640   119.01635   129.81145
   41    40 S   HA   _H4_    40     1.08798   120.23695    -0.27976
   42    39 S   C5B  _C12    52     1.37833   134.16455  -121.28203
   43    42 S   OM   _O36    53     1.33248   125.94140     0.37534
   44    40 S   CA   _C5_    41     1.39623   120.99630   179.75934
   45    44 S   HA   _H5_    42     1.08609   119.35013   179.73459
   46    42 S   C56B _C13    54     1.41614   108.30931  -179.39510
   47    44 S   CA   _C6_    43     1.39205   119.65108    -0.37220
   48    46 S   C56A _C18    55     1.39267   104.84880     0.15949
   49    47 S   CA   _C7_    44     1.39211   120.18047    -0.28804
   50    47 S   OH   _O38    49     1.36734   120.42080   179.88986
   51    50 S   HO   _H12    50     0.97190   108.70342     0.52526
   52    48 S   CA   _C17    56     1.39477   124.15170   179.91607
   53    52 S   HA   _H8_    57     1.08340   121.61718  -179.95577
   54    39 S   OA   _O33    66     1.37218   117.06697    59.61276
   55    38 S   CA   _C8_    45     1.40649   122.45284   -51.56038
   56    55 S   HA   _H6_    46     1.08741   120.15593     0.12972
   57    49 S   OH   _O37    47     1.36714   119.03264  -179.68472
   58    57 S   HO   _H11    48     0.97621   109.38875   179.88809
   59    52 S   CA   _C16    58     1.39778   116.19843     0.01978
   60    59 S   CA   _C15    59     1.39562   122.13637    -0.01978
   61    60 S   HA   _H7_    60     1.08646   120.68587  -180.00000
   62    59 S   OH   _O34    64     1.36994   117.39394   179.98022
   63    62 S   HO   _H9_    65     0.97236   108.54787   180.00000
   64    46 S   CA   _C14    61     1.40929   137.38735  -179.96574
   65    64 S   OH   _O35    62     1.37591   121.94407     0.09487
   66    65 S   HO   _H10    63     0.97578   106.65828    -0.01978
  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   8   5   4   3
  14   6   2   1   1  12   9   8   4   8   4   7   3  10   7   8
   6   3   1   8   4   2   3   1   1   1   6   6   3   2   1   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    40    55    39    42    54  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    40    41    44    49    55    56    39    42    43    46    48    54  
   38    40    55    39    42    54  
   36    37  
   37  
    0  
   40    41    44    45    47    49    55    56    57    39    42    54  
   42    43    46    48    52    64    54    40    55  
   41    44    45    47    49    55    56    50  
   44    45    47    55  
   43    46    48    52    60    64    65    54  
   46    48    64    54  
   45    47    49    55    57    50    51  
   47    49    50  
   48    52    53    59    60    61    64    65    66    54  
   49    55    56    57    58    50    51  
   52    53    59    60    64    65    62    54  
   55    56    57    58    50    51  
   51    55    57  
    0  
   53    59    60    61    64    62    63    54  
   59    60    62    54  
   59    64  
   56    57    58  
   57  
   58  
    0  
   60    61    64    65    62    63  
   61    64    65    66    62    63  
   64    65    62  
   63    64  
    0  
   65    66  
   66  
    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   0.337500   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   3.5500   0.0700   0.136300   2.5000   1.7750   0.001000000  -0.843144165
   40   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   41   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   42   3.5500   0.0700  -0.442700   2.5000   1.7750   0.001000000  -0.843144165
   43   3.1500   0.2500  -0.830000   1.7825   1.5750   0.001000000  -0.126889456
   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   0.258100   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0700   0.323000   2.5000   1.7750   0.001000000  -0.843144165
   49   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   50   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   51   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   52   3.5500   0.0700  -0.324500   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.195500   1.3810   1.2100   0.030040813   0.268726247
   54   3.0000   0.1700  -0.311500   1.7000   1.5000   0.001000000  -0.126889456
   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   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   58   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   59   3.5500   0.0700   0.177000   2.0020   1.7750   0.001000000  -0.843144165
   60   3.5500   0.0700  -0.192500   2.0020   1.7750   0.001000000  -0.843144165
   61   2.4200   0.0300   0.157100   1.3810   1.2100   0.030040813   0.268726247
   62   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   63   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   64   3.5500   0.0700   0.039200   2.0020   1.7750   0.001000000  -0.843144165
   65   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   66   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
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   295.000  1.489
   38    40   469.000  1.400
   38    55   469.000  1.400
   40    41   367.000  1.080
   40    44   469.000  1.400
   44    45   367.000  1.080
   44    47   469.000  1.400
   47    49   469.000  1.400
   47    50   450.000  1.364
   49    55   469.000  1.400
   49    57   450.000  1.364
   55    56   367.000  1.080
   57    58   553.000  0.945
   50    51   553.000  0.945
   39    42   520.000  1.370
   39    54   340.000  1.360
   42    43   480.000  1.345
   42    46   380.000  1.440
   46    48   447.000  1.419
   46    64   469.000  1.404
   48    52   469.000  1.400
   48    54   425.000  1.380
   52    53   367.000  1.080
   52    59   469.000  1.400
   59    60   469.000  1.400
   59    62   450.000  1.364
   60    61   367.000  1.080
   60    64   469.000  1.400
   64    65   450.000  1.364
   65    66   553.000  0.945
   62    63   553.000  0.945
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    80.00000  109.48900
   33    38    40    70.00000  120.00000
   33    38    55    70.00000  120.00000
   33    39    42    55.00000  130.44200
   33    39    54    80.00000  116.10000
   38    33    34    35.00000  109.50000
   38    40    41    35.00000  120.00000
   38    40    44    63.00000  120.00000
   38    55    49    63.00000  120.00000
   38    55    56    35.00000  120.00000
   40    44    45    35.00000  120.00000
   40    44    47    63.00000  120.00000
   44    40    41    35.00000  120.00000
   44    47    49    63.00000  120.00000
   44    47    50    70.00000  120.00000
   47    44    45    35.00000  120.00000
   47    49    55    63.00000  120.00000
   47    49    57    70.00000  120.00000
   47    50    51    35.00000  113.00000
   49    55    56    35.00000  120.00000
   49    57    58    35.00000  113.00000
   55    38    40    63.00000  120.00000
   57    49    55    70.00000  120.00000
   50    47    49    70.00000  120.00000
   39    33    34    45.00000  110.47400
   39    33    38    70.00000  112.04700
   39    42    43    75.00000  125.18600
   39    42    46    80.00000  105.82900
   39    54    48   110.00000  105.28000
   42    46    48    80.00000  107.43600
   42    46    64    50.00000  134.85500
   46    42    43    70.00000  112.00000
   46    48    52    85.00000  122.70000
   46    48    54   100.00000  108.43400
   46    64    60    63.00000  120.00000
   46    64    65    70.00000  120.00000
   48    52    53    35.00000  120.00000
   48    52    59    85.00000  120.00000
   52    59    60    63.00000  120.00000
   52    59    62    70.00000  120.00000
   59    52    53    35.00000  120.00000
   59    60    61    35.00000  120.00000
   59    60    64    63.00000  120.00000
   59    62    63    35.00000  113.00000
   60    64    65    70.00000  120.00000
   64    46    48    85.00000  116.20000
   64    60    61    35.00000  120.00000
   64    65    66    35.00000  113.00000
   62    59    60    70.00000  120.00000
   54    39    42    70.00000  108.00000
   54    48    52    70.00000  124.10000
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  -0.23050  1.0 1.0
   24    29    33    39   0.06200 -1.0 2.0
   24    29    33    39   0.47200  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    40  -0.16000  1.0 1.0
   29    33    38    40  -0.03200 -1.0 2.0
   29    33    38    40   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    42  -0.16000  1.0 1.0
   29    33    39    42  -0.03200 -1.0 2.0
   29    33    39    42   0.04500  1.0 3.0
   29    33    39    54   0.04300 -1.0 2.0
   33    38    40    41   3.62500 -1.0 2.0
   33    38    40    44   3.62500 -1.0 2.0
   33    38    55    49   3.62500 -1.0 2.0
   33    38    55    56   3.62500 -1.0 2.0
   33    39    42    43   3.62500 -1.0 2.0
   33    39    42    46   3.62500 -1.0 2.0
   33    39    54    48   3.62500 -1.0 2.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    38    55   0.00000  1.0 1.0
   34    33    39    42   0.00000  1.0 1.0
   34    33    39    54   0.00000  1.0 1.0
   38    33    39    42   0.04300 -1.0 2.0
   38    33    39    54   0.04300 -1.0 2.0
   38    40    44    45   3.62500 -1.0 2.0
   38    40    44    47   3.62500 -1.0 2.0
   40    38    55    49   3.62500 -1.0 2.0
   40    38    55    56   3.62500 -1.0 2.0
   40    44   -47    49   3.62500 -1.0 2.0
   40    44    47    50   3.62500 -1.0 2.0
   41    40    44    45   3.62500 -1.0 2.0
   41    40    44    47   3.62500 -1.0 2.0
   44    47    49    55   3.62500 -1.0 2.0
   44    47    49    57   3.62500 -1.0 2.0
   44    47    50    51   0.84100 -1.0 2.0
   45    44    47    49   3.62500 -1.0 2.0
   45    44    47    50   3.62500 -1.0 2.0
   47    49   -55    38   3.62500 -1.0 2.0
   47    49    55    56   3.62500 -1.0 2.0
   47    49    57    58   0.84100 -1.0 2.0
   49    47    50    51   0.84100 -1.0 2.0
   55    38    40    41   3.62500 -1.0 2.0
   55    38   -40    44   3.62500 -1.0 2.0
   55    49    57    58   0.84100 -1.0 2.0
   57    49    55    38   3.62500 -1.0 2.0
   57    49    55    56   3.62500 -1.0 2.0
   50    47    49    55   3.62500 -1.0 2.0
   50    47    49    57   3.62500 -1.0 2.0
   39    33    38    40   0.04300 -1.0 2.0
   39    33    38    55   0.04300 -1.0 2.0
   39    42   -46    48   3.50000 -1.0 2.0
   39    42    46    64   3.62500 -1.0 2.0
   42    39   -54    48   3.62500 -1.0 2.0
   42    46    48    52   3.00000 -1.0 2.0
   42    46   -48    54   3.62500 -1.0 2.0
   42    46    64    60   3.62500 -1.0 2.0
   42    46    64    65   3.62500 -1.0 2.0
   43    42    46    48   3.62500 -1.0 2.0
   43    42    46    64   3.62500 -1.0 2.0
   46    48    52    53   3.62500 -1.0 2.0
   46    48    52    59   3.62500 -1.0 2.0
   46    48   -54    39   3.62500 -1.0 2.0
   46    64    65    66   0.84100 -1.0 2.0
   48    46    64    60   3.50000 -1.0 2.0
   48    46    64    65   3.62500 -1.0 2.0
   48    52   -59    60   3.62500 -1.0 2.0
   48    52    59    62   3.62500 -1.0 2.0
   52    48    54    39   3.62500 -1.0 2.0
   52    59    60    61   3.62500 -1.0 2.0
   52    59    60    64   3.62500 -1.0 2.0
   52    59    62    63   0.84100 -1.0 2.0
   53    52    59    60   3.62500 -1.0 2.0
   53    52    59    62   3.62500 -1.0 2.0
   59    60   -64    46   3.62500 -1.0 2.0
   59    60    64    65   3.62500 -1.0 2.0
   60    59    62    63   0.84100 -1.0 2.0
   60    64    65    66   0.84100 -1.0 2.0
   61    60    64    46   3.62500 -1.0 2.0
   61    60    64    65   3.62500 -1.0 2.0
   64    46   -48    52   3.00000 -1.0 2.0
   64    46    48    54   3.62500 -1.0 2.0
   62    59    60    61   3.62500 -1.0 2.0
   62    59    60    64   3.62500 -1.0 2.0
   54    39    42    43   3.62500 -1.0 2.0
   54    39   -42    46   3.62500 -1.0 2.0
   54    48    52    53   3.62500 -1.0 2.0
   54    48    52    59   3.62500 -1.0 2.0
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
   40    55    38    33   4.00000 -1.0 2.0
   44    41    40    38   1.10000 -1.0 2.0
   47    45    44    40   1.10000 -1.0 2.0
   49    50    47    44   4.00000 -1.0 2.0
   55    57    49    47   4.00000 -1.0 2.0
   49    56    55    38   1.10000 -1.0 2.0
   42    54    39    33   4.00000 -1.0 2.0
   46    43    42    39   4.00000 -1.0 2.0
   48    64    46    42   4.00000 -1.0 2.0
   52    54    48    46   4.00000 -1.0 2.0
   59    53    52    48   1.10000 -1.0 2.0
   60    62    59    52   4.00000 -1.0 2.0
   64    61    60    59   1.10000 -1.0 2.0
   60    65    64    46   4.00000 -1.0 2.0
END
