* LIGAND DATABASE FILE (OPLS2005)
*
001      56    57    100    155     291
    1     0 S   NP   _N1_     1    27.99110    96.27834   -23.30320
    2     1 S   H    _HN1     2     1.02776   105.32737  -104.22615
    3     1 S   H    _H1_     3     1.02957    78.18993     1.79657
    4     1 S   H    _H2_     4     1.02835    31.87055   156.41567
    5     1 S   CT   _CA1     5     1.50126   135.40033   108.94378
    6     5 S   HC   _HA1     6     1.09574   105.21791    83.75181
    7     5 S   CO3  _C1_     7     1.53789   112.38424   -36.44602
    8     7 S   O2Z  _O11     8     1.26365   114.99756   -43.48301
    9     7 S   O2Z  _O12     9     1.26237   114.93485   135.65041
   10     5 S   CT   _CB1    10     1.53100   107.42605  -158.32616
   11    10 S   HC   HB11    11     1.09826   109.33971   -50.48364
   12    10 S   HC   HB12    12     1.09816   110.42115    66.07737
   13    10 S   CT   _CG1    13     1.53013   112.66558  -171.55782
   14    13 S   HC   HG11    14     1.09595   110.48455   -64.30331
   15    13 S   HC   HG12    15     1.09657   109.92244    54.89405
   16    13 S   C    _CD1    16     1.51838   112.33981   175.27055
   17    16 S   O    _OE1    17     1.22746   123.30102     0.06853
   18    16 S   N    _N2_    18     1.38558   111.68541  -179.97202
   19    18 S   H    _HN2    19     1.01560   118.98864     4.68563
   20    18 S   CT1  _CA2    20     1.45839   122.92958   177.93398
   21    20 S   HC   _HA2    21     1.09729   108.96290    22.71452
   22    20 S   C    _C2_    22     1.52899   106.99451   -94.32074
   23    22 S   O    _O2_    23     1.22975   123.02489   -27.22038
   24    20 S   CT   _CB2    32     1.53184   112.13862   145.84185
   25    24 S   HC   HB21    33     1.09591   110.19534    53.91987
   26    24 S   HC   HB22    34     1.09446   110.01112   172.99059
   27    22 S   N    _N3_    24     1.38487   112.56076   155.48534
   28    27 S   H    _HN3    25     1.01654   120.36914    -1.85583
   29    24 S   S    _SG2    35     1.82608   110.97278   -66.95509
   30    27 S   CT   _CA3    26     1.45358   122.49716   178.65506
   31    30 S   HC   HA31    27     1.09564   107.77040   -57.03516
   32    30 S   HC   HA32    28     1.09564   107.64878    59.30004
   33    29 S   CT   _C14    36     1.83001    99.83919   169.01067
   34    33 S   HC   _H3_    37     1.09690   109.81281   -46.91380
   35    30 S   CO3  _C3_    29     1.52897   114.31088  -178.86426
   36    35 S   O2Z  _O31    30     1.26341   116.05049     1.26114
   37    35 S   O2Z  _O32    31     1.26437   114.41808  -178.77347
   38    33 S   CO4  _C13    38     1.50819   109.24810    70.17275
   39    38 S   O    _O33    39     1.22782   122.53158   -88.87783
   40    33 S   CM   _C5_    52     1.51281   109.93331  -166.37542
   41    38 S   CA   _C12    40     1.47028   116.84471    87.98254
   42    40 S   CT   _C4_    53     1.52159   112.50594    83.64428
   43    42 S   HC   _H4_    54     1.09483   110.50242   -60.80719
   44    42 S   HC   _H5_    55     1.09391   113.73262   178.83299
   45    42 S   HC   _H6_    56     1.09547   109.94863    58.80243
   46    41 S   CA   _C11    41     1.40291   118.79833  -156.84659
   47    46 S   HA   _H10    42     1.08689   121.04355    -1.27687
   48    46 S   CA   _C10    43     1.39060   119.88584   177.81179
   49    48 S   HA   _H9_    44     1.08583   120.19843  -179.65508
   50    48 S   CA   _C9_    45     1.38955   119.59794    -0.00000
   51    50 S   HA   _H8_    46     1.08631   120.07199  -179.80923
   52    50 S   CA   _C8_    47     1.39922   120.12661     0.48295
   53    52 S   HA   _H7_    48     1.08844   117.39747   179.59170
   54    41 S   CA   _C7_    49     1.40195   119.10914    21.75240
   55    54 S   CMA  _C6_    50     1.51717   122.50012     4.92800
   56    55 S   OM   _O34    51     1.26856   119.18677   163.12158
  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
  13   6   2   1   1  10   4   9  10   6   3   2   1   8   4   6
   3   5   3   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    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    41    55    40    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    41    46    54    55    56    40    42    43    44    45  
   38    39    41    55    40    42  
   36    37  
   37  
    0  
   39    41    46    47    48    52    54    55    40    42  
   41    46    54    40  
   42    43    44    45    41    52    54    55    56  
   46    47    48    49    50    52    53    54    55    56  
   43    44    45    54    55    56  
   44    45    55  
   45    55  
   55  
   47    48    49    50    51    52    54    55  
   48    49    50    54  
   49    50    51    52    53    54  
   50    51    52  
   51    52    53    54    55  
   52    53    54  
   53    54    55    56  
   54    55  
   55    56  
   56  
    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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.4200   0.0150   0.060000   1.3810   1.2100   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   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   39   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   40   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   41   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   42   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   47   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   48   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   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   3.5500   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   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   55   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   56   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
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  1.522
   33    40   317.000  1.510
   38    39   570.000  1.229
   38    41   310.000  1.470
   41    46   469.000  1.400
   41    54   469.000  1.400
   46    47   367.000  1.080
   46    48   469.000  1.400
   48    49   367.000  1.080
   48    50   469.000  1.400
   50    51   367.000  1.080
   50    52   469.000  1.400
   52    53   367.000  1.080
   52    54   469.000  1.400
   54    55   320.000  1.460
   55    56   745.000  1.250
   55    40   465.000  1.376
   40    42   317.000  1.510
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   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    75.00000  110.18000
   29    33    40    75.00000  112.20000
   33    38    39    80.00000  120.40000
   33    38    41    65.00000  115.47100
   33    40    55    70.00000  124.00000
   33    40    42    65.00000  117.92700
   38    33    34    35.00000  109.50000
   38    41    46    60.00000  119.52600
   38    41    54    60.00000  119.52600
   41    38    39    75.00000  123.78400
   41    46    47    35.00000  120.00000
   41    46    48    63.00000  120.00000
   41    54    52    63.00000  120.00000
   41    54    55    60.00000  120.93500
   46    48    49    35.00000  120.00000
   46    48    50    63.00000  120.00000
   48    46    47    35.00000  120.00000
   48    50    51    35.00000  120.00000
   48    50    52    63.00000  120.00000
   50    48    49    35.00000  120.00000
   50    52    53    35.00000  120.00000
   50    52    54    63.00000  120.00000
   52    50    51    35.00000  120.00000
   52    54    55    60.00000  120.93500
   54    41    46    63.00000  120.00000
   54    52    53    35.00000  120.00000
   54    55    56    85.00000  114.86500
   54    55    40    60.00000  123.20500
   55    40    42    70.00000  124.00000
   40    33    34    35.00000  109.50000
   40    33    38    70.00000  109.06800
   40    55    56    65.00000  137.10300
   40    42    43    35.00000  109.50000
   40    42    44    35.00000  109.50000
   40    42    45    35.00000  109.50000
   44    42    43    33.00000  107.80000
   45    42    43    33.00000  107.80000
   45    42    44    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   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    40  -0.62250  1.0 1.0
   24    29    33    40  -0.38450 -1.0 2.0
   24    29    33    40   0.81900  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    39   0.30150 -1.0 2.0
   29    33    38    41   0.65300  1.0 1.0
   29    33    38    41  -0.03850 -1.0 2.0
   29    33    38    41   0.33900  1.0 3.0
   29    33    40    55   0.42700  1.0 1.0
   29    33    40    55  -0.70350 -1.0 2.0
   29    33    40    55  -0.43150  1.0 3.0
   29    33    40    42   0.30250  1.0 1.0
   29    33    40    42  -0.14950 -1.0 2.0
   29    33    40    42   0.36900  1.0 3.0
   33    38    41    46   2.26350  1.0 1.0
   33    38    41    46   0.76750 -1.0 2.0
   33    38    41    46   0.22500  1.0 3.0
   33    38    41    54   2.26350  1.0 1.0
   33    38    41    54   0.76750 -1.0 2.0
   33    38    41    54   0.22500  1.0 3.0
   33    40    42    43   0.34800  1.0 3.0
   33    40    42    44   0.34800  1.0 3.0
   33    40    42    45   0.34800  1.0 3.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    40    55   0.00000  1.0 1.0
   34    33    40    42   0.34800  1.0 3.0
   38    33    40    55  -0.51250  1.0 1.0
   38    33    40    55  -0.88800 -1.0 2.0
   38    33    40    55   0.08850  1.0 3.0
   38    33    40    42   0.17250  1.0 1.0
   38    33    40    42  -0.04100 -1.0 2.0
   38    33    40    42  -0.33850  1.0 3.0
   38    41    46    47   3.62500 -1.0 2.0
   38    41    46    48   3.62500 -1.0 2.0
   38    41    54    52   3.62500 -1.0 2.0
   38    41   -54    55   3.62500 -1.0 2.0
   39    38    41    46   1.05000 -1.0 2.0
   39    38    41    54   1.05000 -1.0 2.0
   41    46    48    49   3.62500 -1.0 2.0
   41    46    48    50   3.62500 -1.0 2.0
   41    54    55    56  -0.01750  1.0 1.0
   41    54    55    56  -0.32000 -1.0 2.0
   41    54    55    56   0.00600  1.0 3.0
   41    54    55    40   0.15800  1.0 1.0
   41    54    55    40   1.85350 -1.0 2.0
   41    54    55    40  -0.48700  1.0 3.0
   46    41    54    52   3.62500 -1.0 2.0
   46    41    54    55   3.62500 -1.0 2.0
   46    48    50    51   3.62500 -1.0 2.0
   46    48   -50    52   3.62500 -1.0 2.0
   47    46    48    49   3.62500 -1.0 2.0
   47    46    48    50   3.62500 -1.0 2.0
   48    50    52    53   3.62500 -1.0 2.0
   48    50    52    54   3.62500 -1.0 2.0
   49    48    50    51   3.62500 -1.0 2.0
   49    48    50    52   3.62500 -1.0 2.0
   50    52   -54    41   3.62500 -1.0 2.0
   50    52    54    55   3.62500 -1.0 2.0
   51    50    52    53   3.62500 -1.0 2.0
   51    50    52    54   3.62500 -1.0 2.0
   52    54    55    56  -0.01750  1.0 1.0
   52    54    55    56  -0.32000 -1.0 2.0
   52    54    55    56   0.00600  1.0 3.0
   52    54    55    40   0.15800  1.0 1.0
   52    54    55    40   1.85350 -1.0 2.0
   52    54    55    40  -0.48700  1.0 3.0
   53    52    54    41   3.62500 -1.0 2.0
   53    52    54    55   3.62500 -1.0 2.0
   54    41    46    47   3.62500 -1.0 2.0
   54    41   -46    48   3.62500 -1.0 2.0
   54    55   -40    33   7.00000 -1.0 2.0
   54    55    40    42   7.00000 -1.0 2.0
   55    40    42    43   0.00000  1.0 1.0
   55    40    42    44   0.00000  1.0 1.0
   55    40    42    45   0.00000  1.0 1.0
   56    55    40    33   7.00000 -1.0 2.0
   56    55    40    42   7.00000 -1.0 2.0
   40    33    38    39   0.30150 -1.0 2.0
   40    33   -38    41   0.65300  1.0 1.0
   40    33   -38    41  -0.03850 -1.0 2.0
   40    33   -38    41   0.33900  1.0 3.0
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
   33    41    38    39  10.50000 -1.0 2.0
   46    54    41    38   4.00000 -1.0 2.0
   48    47    46    41   1.10000 -1.0 2.0
   50    49    48    46   1.10000 -1.0 2.0
   52    51    50    48   1.10000 -1.0 2.0
   54    53    52    50   1.10000 -1.0 2.0
   52    55    54    41   4.00000 -1.0 2.0
   54    56    55    40   1.10000 -1.0 2.0
   33    42    40    55   1.10000 -1.0 2.0
END
