* LIGAND DATABASE FILE (OPLS2005)
*
001      58    60    115    191     341
    1     0 S   NP   _N1_     1    29.01176    94.61587   -20.90609
    2     1 S   H    _HN1     2     1.02954    86.41736    35.46251
    3     1 S   H    _H1_     3     1.02832    32.26886   165.89185
    4     1 S   H    _H2_     4     1.02778    92.05457   -72.83501
    5     1 S   CT   _CA1     5     1.50139   142.61471   154.99112
    6     5 S   HC   _HA1     6     1.09577   105.16287    65.31132
    7     5 S   CO3  _C1_     7     1.53704   112.47605   -54.76603
    8     7 S   O2Z  _O11     8     1.26355   114.97920   -40.74586
    9     7 S   O2Z  _O12     9     1.26231   114.91080   138.33175
   10     5 S   CT   _CB1    10     1.53070   107.41120  -176.80806
   11    10 S   HC   HB11    11     1.09823   109.10676   -50.40830
   12    10 S   HC   HB12    12     1.09821   110.50400    66.10210
   13    10 S   CT   _CG1    13     1.53024   112.78625  -171.54235
   14    13 S   HC   HG11    14     1.09584   110.44060   -67.67604
   15    13 S   HC   HG12    15     1.09663   109.98492    51.56795
   16    13 S   C    _CD1    16     1.51841   112.26269   171.66530
   17    16 S   O    _OE1    17     1.22735   123.24660    -0.36957
   18    16 S   N    _N2_    18     1.38624   111.71474   179.92338
   19    18 S   H    _HN2    19     1.01607   118.95246    -0.00000
   20    18 S   CT1  _CA2    20     1.46272   123.36708   178.22095
   21    20 S   HC   _HA2    21     1.09749   109.21368   -14.04224
   22    20 S   C    _C2_    22     1.53389   108.14257  -129.36171
   23    22 S   O    _O2_    23     1.23012   122.46982  -146.88120
   24    20 S   CT   _CB2    32     1.53354   111.78006   108.17497
   25    24 S   HC   HB21    33     1.09501   110.19202    56.42721
   26    24 S   HC   HB22    34     1.09530   110.47907   174.46551
   27    22 S   N    _N3_    24     1.38399   113.35267    40.58574
   28    27 S   H    _HN3    25     1.01654   119.50387    -3.55430
   29    24 S   S    _SG2    35     1.82777   111.49852   -66.94400
   30    27 S   CT   _CA3    26     1.45286   123.09877   176.95348
   31    30 S   HC   HA31    27     1.09553   107.55817   -63.00194
   32    30 S   HC   HA32    28     1.09559   107.90598    53.39433
   33    29 S   CT   _C8_    36     1.83872   100.21106   136.65403
   34    33 S   HC   _H6_    37     1.09493   108.24049    50.48100
   35    30 S   CO3  _C3_    29     1.52929   114.14797   175.36540
   36    35 S   O2Z  _O31    30     1.26363   116.05633    -0.39267
   37    35 S   O2Z  _O32    31     1.26429   114.41114   179.65113
   38    33 S   CT   _C4_    38     1.54148   111.21501   -72.55104
   39    38 S   HC   _H7_    39     1.09466   108.75929   160.28969
   40    38 S   HC   _H8_    40     1.09399   114.29596    41.77688
   41    38 S   CT   _C5_    41     1.53346   104.51238   -80.28461
   42    41 S   HC   _H3_    42     1.09841   108.09978    92.45496
   43    41 S   CT   _C6_    43     1.56919   106.00762   -24.13733
   44    43 S   HC   _H4_    44     1.09873   108.58146   115.12304
   45    33 S   CT   _C7_    45     1.54434   113.90124   174.03136
   46    45 S   Cl   Cl1_    46     1.77314   115.79912   -47.94382
   47    45 S   HC   _H5_    47     1.09342   107.44579  -164.91738
   48    43 S   CT   _C9_    48     1.56478   102.48315  -127.95870
   49    48 S   Cl   Cl7_    49     1.75080   113.99946  -161.17334
   50    48 S   CM   _C10    50     1.51618   108.51501    67.16587
   51    50 S   Cl   Cl6_    51     1.69396   124.54312   110.08440
   52    50 S   CM   _C11    52     1.33867   107.49575   -69.23797
   53    52 S   Cl   Cl5_    53     1.69398   127.82464   179.36820
   54    41 S   CT   _C12    54     1.55970   120.08758  -139.75728
   55    54 S   Cl   Cl4_    55     1.74903   113.76385   -79.70469
   56    48 S   CT   _C13    56     1.56923   101.76075   -36.23311
   57    56 S   Cl   Cl2_    57     1.79476   114.66130   -61.09689
   58    56 S   Cl   Cl3_    58     1.80429   114.54917   175.64702
  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  10   5   4   3
  13   8   2   1   1  14   6   5  16   8  14   8   7   2   1  10
   7   8   4   6   3   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    45    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    43    45    46    47  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    44    45    46    47    48    54  
   38    39    40    41    43    45    46    47  
   36    37  
   37  
    0  
   39    40    41    42    43    44    45    46    47    48    52    54    55    56  
   40    41    42    43    45    54  
   41    42    43    45    54  
   42    43    44    45    46    47    48    49    50    52    53    54    55    56    57    58  
   43    44    45    48    52    54    55    56  
   44    45    46    47    48    49    50    51    52    54    55    56    57    58  
   45    46    47    48    49    50    54    56  
   46    47    48    49    50    54    56  
   47    48  
   48  
   49    50    51    52    53    54    55    56    57    58  
   50    51    52    54    56    57    58  
   51    52    53    54    55    56    57    58  
   52    53    54    56  
   53    54    55    56    57    58  
   54    55    56  
   55    56    57    58  
   56    57    58  
   57    58  
   58  
    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   2.5000   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660   0.097000   1.9750   1.7500   0.005000000  -0.741685710
   46   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   47   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   49   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   50   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   51   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   52   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   53   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   54   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   55   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   56   3.5000   0.0660   0.271600   1.9750   1.7500   0.005000000  -0.741685710
   57   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   58   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
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   268.000  1.529
   33    45   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   268.000  1.529
   41    42   340.000  1.090
   41    43   268.000  1.529
   41    54   268.000  1.529
   43    44   340.000  1.090
   43    45   268.000  1.529
   43    48   268.000  1.529
   45    46   245.000  1.781
   45    47   340.000  1.090
   48    49   245.000  1.781
   48    50   317.000  1.510
   48    56   268.000  1.529
   50    51   300.000  1.725
   50    52   549.000  1.340
   52    53   300.000  1.725
   52    54   317.000  1.510
   54    55   245.000  1.781
   54    56   268.000  1.529
   56    57   245.000  1.781
   56    58   245.000  1.781
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  111.63000
   29    33    45    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    58.35000  112.70000
   33    45    43    58.35000  112.70000
   33    45    46    69.00000  109.80000
   33    45    47    37.50000  110.70000
   38    33    34    37.50000  110.70000
   38    41    42    37.50000  110.70000
   38    41    43    58.35000  112.70000
   38    41    54    58.35000  112.70000
   40    38    39    33.00000  107.80000
   41    38    39    37.50000  110.70000
   41    38    40    37.50000  110.70000
   41    43    44    37.50000  110.70000
   41    43    45    58.35000  112.70000
   41    43    48    58.35000  112.70000
   41    54    52    70.00000  112.02700
   41    54    55    69.00000  109.80000
   41    54    56    58.35000  112.70000
   43    41    42    37.50000  110.70000
   43    45    46    69.00000  109.80000
   43    45    47    37.50000  110.70000
   43    48    49    69.00000  109.80000
   43    48    50    70.00000  112.02700
   43    48    56    58.35000  112.70000
   45    33    34    37.50000  110.70000
   45    33    38    58.35000  112.70000
   45    43    44    37.50000  110.70000
   47    45    46    51.00000  107.60000
   48    43    44    37.50000  110.70000
   48    43    45    58.35000  112.70000
   48    50    51    75.00000  111.02000
   48    50    52    70.00000  124.00000
   48    56    54    58.35000  112.70000
   48    56    57    69.00000  109.80000
   48    56    58    69.00000  109.80000
   50    48    49    75.00000  111.90500
   50    52    53    75.00000  121.50000
   50    52    54    70.00000  124.00000
   52    50    51    75.00000  121.50000
   52    54    55    75.00000  111.90500
   52    54    56    70.00000  112.02700
   54    41    42    37.50000  110.70000
   54    41    43    58.35000  112.70000
   54    52    53    75.00000  111.02000
   54    56    57    69.00000  109.80000
   54    56    58    69.00000  109.80000
   56    48    49    69.00000  109.80000
   56    48    50    70.00000  112.02700
   56    54    55    69.00000  109.80000
   58    56    57    80.00000  110.42200
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    45   0.01700  1.0 1.0
   24    29    33    45  -0.23550 -1.0 2.0
   24    29    33    45   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    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.44750  1.0 1.0
   29    33    38    41  -0.17800 -1.0 2.0
   29    33    38    41   0.20200  1.0 3.0
   29    33    45    43   0.44750  1.0 1.0
   29    33    45    43  -0.17800 -1.0 2.0
   29    33    45    43   0.20200  1.0 3.0
   29    33    45    46   0.56750  1.0 1.0
   29    33    45    46  -0.07550 -1.0 2.0
   29    33    45    46   0.20000  1.0 3.0
   29    33    45    47   0.15000  1.0 3.0
   33    38    41    42   0.15000  1.0 3.0
   33    38   -41    43   0.56750  1.0 1.0
   33    38   -41    43  -0.07550 -1.0 2.0
   33    38   -41    43   0.20000  1.0 3.0
   33    38    41    54   0.56750  1.0 1.0
   33    38    41    54  -0.07550 -1.0 2.0
   33    38    41    54   0.20000  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    41   0.15000  1.0 3.0
   34    33    45    43   0.15000  1.0 3.0
   34    33    45    46   0.27000  1.0 3.0
   34    33    45    47   0.15000  1.0 3.0
   38    33   -45    43   0.56750  1.0 1.0
   38    33   -45    43  -0.07550 -1.0 2.0
   38    33   -45    43   0.20000  1.0 3.0
   38    33    45    46   0.35600  1.0 1.0
   38    33    45    46  -0.14650 -1.0 2.0
   38    33    45    46   0.33350  1.0 3.0
   38    33    45    47   0.15000  1.0 3.0
   38    41    43    44   0.15000  1.0 3.0
   38    41   -43    45   0.56750  1.0 1.0
   38    41   -43    45  -0.07550 -1.0 2.0
   38    41   -43    45   0.20000  1.0 3.0
   38    41    43    48   0.56750  1.0 1.0
   38    41    43    48  -0.07550 -1.0 2.0
   38    41    43    48   0.20000  1.0 3.0
   38    41    54    52   0.34400  1.0 1.0
   38    41    54    52   0.09450 -1.0 2.0
   38    41    54    52   0.11100  1.0 3.0
   38    41    54    55   0.35600  1.0 1.0
   38    41    54    55  -0.14650 -1.0 2.0
   38    41    54    55   0.33350  1.0 3.0
   38    41    54    56   0.56750  1.0 1.0
   38    41    54    56  -0.07550 -1.0 2.0
   38    41    54    56   0.20000  1.0 3.0
   39    38    41    42   0.15000  1.0 3.0
   39    38    41    43   0.15000  1.0 3.0
   39    38    41    54   0.15000  1.0 3.0
   40    38    41    42   0.15000  1.0 3.0
   40    38    41    43   0.15000  1.0 3.0
   40    38    41    54   0.15000  1.0 3.0
   41    43   -45    33   0.56750  1.0 1.0
   41    43   -45    33  -0.07550 -1.0 2.0
   41    43   -45    33   0.20000  1.0 3.0
   41    43    45    46   0.35600  1.0 1.0
   41    43    45    46  -0.14650 -1.0 2.0
   41    43    45    46   0.33350  1.0 3.0
   41    43    45    47   0.15000  1.0 3.0
   41    43    48    49   0.35600  1.0 1.0
   41    43    48    49  -0.14650 -1.0 2.0
   41    43    48    49   0.33350  1.0 3.0
   41    43    48    50   0.34400  1.0 1.0
   41    43    48    50   0.09450 -1.0 2.0
   41    43    48    50   0.11100  1.0 3.0
   41    43   -48    56   0.56750  1.0 1.0
   41    43   -48    56  -0.07550 -1.0 2.0
   41    43   -48    56   0.20000  1.0 3.0
   41    54   -56    48   0.56750  1.0 1.0
   41    54   -56    48  -0.07550 -1.0 2.0
   41    54   -56    48   0.20000  1.0 3.0
   41    54    56    57   0.35600  1.0 1.0
   41    54    56    57  -0.14650 -1.0 2.0
   41    54    56    57   0.33350  1.0 3.0
   41    54    56    58   0.35600  1.0 1.0
   41    54    56    58  -0.14650 -1.0 2.0
   41    54    56    58   0.33350  1.0 3.0
   42    41    43    44   0.15000  1.0 3.0
   42    41    43    45   0.15000  1.0 3.0
   42    41    43    48   0.15000  1.0 3.0
   42    41    54    52   0.15000  1.0 3.0
   42    41    54    55   0.27000  1.0 3.0
   42    41    54    56   0.15000  1.0 3.0
   43    41    54    52   0.34400  1.0 1.0
   43    41    54    52   0.09450 -1.0 2.0
   43    41    54    52   0.11100  1.0 3.0
   43    41    54    55   0.35600  1.0 1.0
   43    41    54    55  -0.14650 -1.0 2.0
   43    41    54    55   0.33350  1.0 3.0
   43    41   -54    56   0.56750  1.0 1.0
   43    41   -54    56  -0.07550 -1.0 2.0
   43    41   -54    56   0.20000  1.0 3.0
   43    48    50    51   0.09700  1.0 1.0
   43    48    50    51   0.15600 -1.0 2.0
   43    48    50    51  -0.50800  1.0 3.0
   43    48   -50    52   0.09850  1.0 1.0
   43    48   -50    52   0.15250 -1.0 2.0
   43    48   -50    52  -0.50650  1.0 3.0
   43    48   -56    54   0.56750  1.0 1.0
   43    48   -56    54  -0.07550 -1.0 2.0
   43    48   -56    54   0.20000  1.0 3.0
   43    48    56    57   0.35600  1.0 1.0
   43    48    56    57  -0.14650 -1.0 2.0
   43    48    56    57   0.33350  1.0 3.0
   43    48    56    58   0.35600  1.0 1.0
   43    48    56    58  -0.14650 -1.0 2.0
   43    48    56    58   0.33350  1.0 3.0
   44    43    45    33   0.15000  1.0 3.0
   44    43    45    46   0.27000  1.0 3.0
   44    43    45    47   0.15000  1.0 3.0
   44    43    48    49   0.27000  1.0 3.0
   44    43    48    50   0.15000  1.0 3.0
   44    43    48    56   0.15000  1.0 3.0
   45    33    38    39   0.15000  1.0 3.0
   45    33    38    40   0.15000  1.0 3.0
   45    33   -38    41   0.56750  1.0 1.0
   45    33   -38    41  -0.07550 -1.0 2.0
   45    33   -38    41   0.20000  1.0 3.0
   45    43    48    49   0.35600  1.0 1.0
   45    43    48    49  -0.14650 -1.0 2.0
   45    43    48    49   0.33350  1.0 3.0
   45    43    48    50   0.34400  1.0 1.0
   45    43    48    50   0.09450 -1.0 2.0
   45    43    48    50   0.11100  1.0 3.0
   45    43    48    56   0.56750  1.0 1.0
   45    43    48    56  -0.07550 -1.0 2.0
   45    43    48    56   0.20000  1.0 3.0
   48    43    45    33   0.56750  1.0 1.0
   48    43    45    33  -0.07550 -1.0 2.0
   48    43    45    33   0.20000  1.0 3.0
   48    43    45    46   0.35600  1.0 1.0
   48    43    45    46  -0.14650 -1.0 2.0
   48    43    45    46   0.33350  1.0 3.0
   48    43    45    47   0.15000  1.0 3.0
   48    50    52    53   7.00000 -1.0 2.0
   48    50   -52    54   7.00000 -1.0 2.0
   49    48    50    51   0.09700  1.0 1.0
   49    48    50    51   0.15600 -1.0 2.0
   49    48    50    51  -0.50800  1.0 3.0
   49    48    50    52   0.09700  1.0 1.0
   49    48    50    52   0.15600 -1.0 2.0
   49    48    50    52  -0.50800  1.0 3.0
   49    48    56    54   0.35600  1.0 1.0
   49    48    56    54  -0.14650 -1.0 2.0
   49    48    56    54   0.33350  1.0 3.0
   49    48    56    57   0.22500  1.0 1.0
   49    48    56    58   0.22500  1.0 1.0
   50    48   -56    54   0.34400  1.0 1.0
   50    48   -56    54   0.09450 -1.0 2.0
   50    48   -56    54   0.11100  1.0 3.0
   50    48    56    57   0.56750  1.0 1.0
   50    48    56    57  -0.07550 -1.0 2.0
   50    48    56    57   0.20000  1.0 3.0
   50    48    56    58   0.56750  1.0 1.0
   50    48    56    58  -0.07550 -1.0 2.0
   50    48    56    58   0.20000  1.0 3.0
   50    52   -54    41   0.09850  1.0 1.0
   50    52   -54    41   0.15250 -1.0 2.0
   50    52   -54    41  -0.50650  1.0 3.0
   50    52    54    55   0.09700  1.0 1.0
   50    52    54    55   0.15600 -1.0 2.0
   50    52    54    55  -0.50800  1.0 3.0
   50    52   -54    56   0.09850  1.0 1.0
   50    52   -54    56   0.15250 -1.0 2.0
   50    52   -54    56  -0.50650  1.0 3.0
   51    50    52    53   7.00000 -1.0 2.0
   51    50    52    54   7.00000 -1.0 2.0
   52    54   -56    48   0.34400  1.0 1.0
   52    54   -56    48   0.09450 -1.0 2.0
   52    54   -56    48   0.11100  1.0 3.0
   52    54    56    57   0.56750  1.0 1.0
   52    54    56    57  -0.07550 -1.0 2.0
   52    54    56    57   0.20000  1.0 3.0
   52    54    56    58   0.56750  1.0 1.0
   52    54    56    58  -0.07550 -1.0 2.0
   52    54    56    58   0.20000  1.0 3.0
   53    52    54    41   0.09700  1.0 1.0
   53    52    54    41   0.15600 -1.0 2.0
   53    52    54    41  -0.50800  1.0 3.0
   53    52    54    55   0.09700  1.0 1.0
   53    52    54    55   0.15600 -1.0 2.0
   53    52    54    55  -0.50800  1.0 3.0
   53    52    54    56   0.09700  1.0 1.0
   53    52    54    56   0.15600 -1.0 2.0
   53    52    54    56  -0.50800  1.0 3.0
   54    41    43    44   0.15000  1.0 3.0
   54    41    43    45   0.56750  1.0 1.0
   54    41    43    45  -0.07550 -1.0 2.0
   54    41    43    45   0.20000  1.0 3.0
   54    41   -43    48   0.56750  1.0 1.0
   54    41   -43    48  -0.07550 -1.0 2.0
   54    41   -43    48   0.20000  1.0 3.0
   55    54    56    48   0.35600  1.0 1.0
   55    54    56    48  -0.14650 -1.0 2.0
   55    54    56    48   0.33350  1.0 3.0
   55    54    56    57   0.22500  1.0 1.0
   55    54    56    58   0.22500  1.0 1.0
   56    48    50    51   0.09700  1.0 1.0
   56    48    50    51   0.15600 -1.0 2.0
   56    48    50    51  -0.50800  1.0 3.0
   56    48   -50    52   0.09850  1.0 1.0
   56    48   -50    52   0.15250 -1.0 2.0
   56    48   -50    52  -0.50650  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
   48    51    50    52   1.10000 -1.0 2.0
   54    53    52    50   1.10000 -1.0 2.0
END
