* LIGAND DATABASE FILE (OPLS2005)
*
001      58    58     99    153     294
    1     0 S   NP   _N1_     1    28.93176    93.33374   -21.64383
    2     1 S   H    _HN1     2     1.02772    89.68237   -83.89207
    3     1 S   H    _H1_     3     1.03112   100.85052    24.33809
    4     1 S   H    _H2_     4     1.02808    23.12654   132.87268
    5     1 S   CT   _CA1     5     1.50301   132.71727   155.55080
    6     5 S   HC   _HA1     6     1.09545   105.42131    52.59307
    7     5 S   CO3  _C1_     7     1.53884   112.35293   -67.92480
    8     7 S   O2Z  _O11     8     1.26397   115.15488   -41.67880
    9     7 S   O2Z  _O12     9     1.26256   114.86154   137.46801
   10     5 S   CT   _CB1    10     1.52806   106.89265   170.64850
   11    10 S   HC   HB11    11     1.09828   109.57594   -49.64802
   12    10 S   HC   HB12    12     1.09401   109.61425    66.68394
   13    10 S   CT   _CG1    13     1.52804   114.06479  -171.81885
   14    13 S   HC   HG11    14     1.09550   110.56487   -56.89481
   15    13 S   HC   HG12    15     1.09567   110.42215    62.87214
   16    13 S   C    _CD1    16     1.51887   110.97998  -176.94732
   17    16 S   O    _OE1    17     1.22809   123.08245   -12.90785
   18    16 S   N    _N2_    18     1.38523   112.09697   167.37842
   19    18 S   H    _HN2    19     1.01582   119.32277     1.92326
   20    18 S   CT1  _CA2    20     1.46080   122.78055  -177.72351
   21    20 S   HC   _HA2    21     1.09579   109.05436   -11.59950
   22    20 S   C    _C2_    22     1.53430   108.71238  -126.89244
   23    22 S   O    _O2_    23     1.23023   122.13725  -147.41938
   24    20 S   CT   _CB2    32     1.53484   111.75522   110.58013
   25    24 S   HC   HB21    33     1.09670   109.35922    61.73444
   26    24 S   HC   HB22    34     1.09588   110.97102   178.79894
   27    22 S   N    _N3_    24     1.38478   113.43003    39.97376
   28    27 S   H    _HN3    25     1.01528   118.87821    -0.76438
   29    24 S   S    _SG2    35     1.82418   114.40913   -57.60695
   30    27 S   CT   _CA3    26     1.45470   123.63444   175.16211
   31    30 S   HC   HA31    27     1.09511   109.41825    19.91819
   32    30 S   HC   HA32    28     1.09500   107.04913   136.96781
   33    29 S   CO4  _C12    36     1.76226   101.24031   -79.60758
   34    33 S   O    _O35    37     1.22550   122.84379    20.48550
   35    30 S   CO3  _C3_    29     1.52934   113.10922  -103.68857
   36    35 S   O2Z  _O31    30     1.26406   115.43479   -42.59648
   37    35 S   O2Z  _O32    31     1.26360   114.95334   138.34639
   38    33 S   CT   _C11    38     1.51522   114.55035  -159.29438
   39    38 S   HC   _H8_    39     1.09614   111.18814     7.77117
   40    38 S   HC   _H9_    40     1.09865   105.82503   122.26012
   41    38 S   CT   _C10    41     1.53794   111.60859  -117.83387
   42    41 S   HC   _H3_    42     1.09773   108.20738   -52.36435
   43    41 S   CA   _C5_    43     1.51962   113.21283    68.30676
   44    41 S   NT   _N4_    56     1.46817   109.12352  -168.57671
   45    44 S   H    _H10    57     1.01973   109.41382   173.79363
   46    44 S   H    _H11    58     1.01937   109.65691    57.86853
   47    43 S   CA   _C4_    44     1.40421   119.83843  -123.49582
   48    47 S   HA   _H4_    45     1.08743   119.83413     1.30236
   49    47 S   CA   _C9_    46     1.39686   120.36271  -178.76267
   50    49 S   CA   _C8_    47     1.39267   120.50823    -0.22985
   51    49 S   OH   _O33    54     1.36848   120.33692  -179.34032
   52    51 S   HO   _H6_    55     0.97239   108.62257     1.83024
   53    50 S   CA   _C7_    48     1.39415   119.67923     0.13706
   54    53 S   Cl   Cl1_    49     1.72481   120.85858  -179.86583
   55    50 S   OH   _O34    52     1.36936   118.82057  -178.86116
   56    55 S   HO   _H7_    53     0.97497   107.62875   170.90832
   57    43 S   CA   _C6_    50     1.40588   121.45840    57.87847
   58    57 S   HA   _H5_    51     1.08792   119.77197    -0.45542
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   7   3   2   7   4   6   5   4   3
   8   4   2   1   1  10   5   4  11   6  12   4   1   1   9   4
   8   8   3   1   5   3   2   1   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    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    44  
   38    39    40    41  
   36    37  
   37  
    0  
   39    40    41    42    43    47    57    44    45    46  
   40    41    42    43    44  
   41    42    43    44  
   42    43    47    48    49    53    57    58    44    45    46  
   43    47    57    44    45    46  
   47    48    49    50    53    54    57    58    51    44    45    46  
   45    46    47    57  
   46  
    0  
   48    49    50    53    57    58    55    51    52  
   49    50    57    51  
   50    53    54    57    55    56    51    52  
   53    54    57    58    55    56    51    52  
   52    53    55  
    0  
   54    57    58    55    56  
   57    58    55  
   56    57  
    0  
   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  -0.219900   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   3.7500   0.1050   0.482400   2.1120   1.8750   0.001000000  -0.126889456
   34   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   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   0.235000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.3000   0.1700  -0.900000   1.8650   1.6500   0.051222218  -2.220205820
   45   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   46   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   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   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   50   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   51   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   52   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   53   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   54   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   55   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   56   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   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   210.000  1.799
   33    34   570.000  1.229
   33    38   317.000  1.522
   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   317.000  1.510
   41    44   382.000  1.448
   43    47   469.000  1.400
   43    57   469.000  1.400
   47    48   367.000  1.080
   47    49   469.000  1.400
   49    50   469.000  1.400
   49    51   450.000  1.364
   50    53   469.000  1.400
   50    55   450.000  1.364
   53    54   300.000  1.725
   53    57   469.000  1.400
   57    58   367.000  1.080
   55    56   553.000  0.945
   51    52   553.000  0.945
   44    45   434.000  1.010
   44    46   434.000  1.010
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    90.00000   96.72000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    80.00000  121.30200
   29    33    38    70.00000  114.16300
   33    38    39    35.00000  109.50000
   33    38    40    35.00000  109.50000
   33    38    41    63.00000  111.10000
   38    33    34    80.00000  120.40000
   38    41    42    37.50000  110.70000
   38    41    43    70.00000  112.17500
   38    41    44    56.20000  109.47000
   40    38    39    33.00000  107.80000
   41    38    39    37.50000  110.70000
   41    38    40    37.50000  110.70000
   41    43    47    70.00000  120.00000
   41    43    57    70.00000  120.00000
   41    44    45    35.00000  109.50000
   41    44    46    35.00000  109.50000
   43    41    42    35.00000  109.50000
   43    47    48    35.00000  120.00000
   43    47    49    63.00000  120.00000
   43    57    53    63.00000  120.00000
   43    57    58    35.00000  120.00000
   47    49    50    63.00000  120.00000
   47    49    51    70.00000  120.00000
   49    47    48    35.00000  120.00000
   49    50    53    63.00000  120.00000
   49    50    55    70.00000  120.00000
   49    51    52    35.00000  113.00000
   50    53    54    75.00000  120.00000
   50    53    57    63.00000  120.00000
   50    55    56    35.00000  113.00000
   53    57    58    35.00000  120.00000
   57    43    47    63.00000  120.00000
   57    53    54    75.00000  120.00000
   55    50    53    70.00000  120.00000
   51    49    50    70.00000  120.00000
   44    41    42    35.00000  109.50000
   44    41    43    75.00000  112.33000
   46    44    45    43.60000  106.40000
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   0.00000  1.0 1.0
   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  -0.11550  1.0 1.0
   24    29    33    34   1.88700 -1.0 2.0
   24    29    33    38  -0.11550  1.0 1.0
   24    29    33    38   1.88700 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    38    39   0.00000  1.0 1.0
   29    33    38    40   0.00000  1.0 1.0
   29    33    38    41   0.00000  1.0 1.0
   33    38    41    42  -0.11250  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    44  -3.56550  1.0 1.0
   33    38    41    44  -0.67500 -1.0 2.0
   33    38    41    44   1.11300  1.0 3.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    38    41   0.30150 -1.0 2.0
   38    41    43    47   0.04150 -1.0 2.0
   38    41    43    57   0.04150 -1.0 2.0
   38    41    44    45  -0.05950  1.0 1.0
   38    41    44    45   0.08850 -1.0 2.0
   38    41    44    45   0.11750  1.0 3.0
   38    41    44    46  -0.05950  1.0 1.0
   38    41    44    46   0.08850 -1.0 2.0
   38    41    44    46   0.11750  1.0 3.0
   39    38    41    42   0.15000  1.0 3.0
   39    38    41    43   0.43200  1.0 3.0
   39    38    41    44   0.15000  1.0 3.0
   40    38    41    42   0.15000  1.0 3.0
   40    38    41    43   0.43200  1.0 3.0
   40    38    41    44   0.15000  1.0 3.0
   41    43    47    48   3.62500 -1.0 2.0
   41    43    47    49   3.62500 -1.0 2.0
   41    43    57    53   3.62500 -1.0 2.0
   41    43    57    58   3.62500 -1.0 2.0
   42    41    43    47   0.00000  1.0 1.0
   42    41    43    57   0.00000  1.0 1.0
   42    41    44    45   0.20000  1.0 3.0
   42    41    44    46   0.20000  1.0 3.0
   43    41    44    45   0.76500  1.0 1.0
   43    41    44    45   0.05700 -1.0 2.0
   43    41    44    45  -0.90900  1.0 3.0
   43    41    44    46   0.76500  1.0 1.0
   43    41    44    46   0.05700 -1.0 2.0
   43    41    44    46  -0.90900  1.0 3.0
   43    47    49    50   3.62500 -1.0 2.0
   43    47    49    51   3.62500 -1.0 2.0
   47    43    57    53   3.62500 -1.0 2.0
   47    43    57    58   3.62500 -1.0 2.0
   47    49   -50    53   3.62500 -1.0 2.0
   47    49    50    55   3.62500 -1.0 2.0
   47    49    51    52   0.84100 -1.0 2.0
   48    47    49    50   3.62500 -1.0 2.0
   48    47    49    51   3.62500 -1.0 2.0
   49    50    53    54   3.62500 -1.0 2.0
   49    50    53    57   3.62500 -1.0 2.0
   49    50    55    56   0.84100 -1.0 2.0
   50    49    51    52   0.84100 -1.0 2.0
   50    53   -57    43   3.62500 -1.0 2.0
   50    53    57    58   3.62500 -1.0 2.0
   53    50    55    56   0.84100 -1.0 2.0
   54    53    57    43   3.62500 -1.0 2.0
   54    53    57    58   3.62500 -1.0 2.0
   57    43    47    48   3.62500 -1.0 2.0
   57    43   -47    49   3.62500 -1.0 2.0
   55    50    53    54   3.62500 -1.0 2.0
   55    50    53    57   3.62500 -1.0 2.0
   51    49    50    53   3.62500 -1.0 2.0
   51    49    50    55   3.62500 -1.0 2.0
   44    41    43    47   0.18550 -1.0 2.0
   44    41    43    47   0.14000  1.0 3.0
   44    41    43    57   0.18550 -1.0 2.0
   44    41    43    57   0.14000  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
   29    38    33    34  10.50000 -1.0 2.0
   47    57    43    41   4.00000 -1.0 2.0
   49    48    47    43   1.10000 -1.0 2.0
   50    51    49    47   4.00000 -1.0 2.0
   53    55    50    49   4.00000 -1.0 2.0
   57    54    53    50   4.00000 -1.0 2.0
   53    58    57    43   1.10000 -1.0 2.0
END
