* LIGAND DATABASE FILE (OPLS2005)
*
001      57    58     98    157     289
    1     0 S   NP   _N1_     1    28.61878    93.56917   -23.46725
    2     1 S   H    _HN1     2     1.02961    87.58527    32.75081
    3     1 S   H    _H1_     3     1.02838    21.24049  -170.67873
    4     1 S   H    _H2_     4     1.02777   107.31174   -75.70707
    5     1 S   CT   _CA1     5     1.50122   127.40316   146.75794
    6     5 S   HC   _HA1     6     1.09576   105.22835    74.32958
    7     5 S   CO3  _C1_     7     1.53783   112.39019   -45.86133
    8     7 S   O2Z  _O11     8     1.26357   114.99857   -43.71693
    9     7 S   O2Z  _O12     9     1.26240   114.91744   135.45098
   10     5 S   CT   _CB1    10     1.53099   107.43254  -167.77550
   11    10 S   HC   HB11    11     1.09824   109.31207   -50.95535
   12    10 S   HC   HB12    12     1.09820   110.41726    65.58547
   13    10 S   CT   _CG1    13     1.53012   112.69073  -172.07556
   14    13 S   HC   HG11    14     1.09601   110.42259   -64.02755
   15    13 S   HC   HG12    15     1.09653   109.99552    55.19299
   16    13 S   C    _CD1    16     1.51824   112.33598   175.52998
   17    16 S   O    _OE1    17     1.22721   123.27986    -2.39760
   18    16 S   N    _N2_    18     1.38628   111.63673   177.79096
   19    18 S   H    _HN2    19     1.01593   119.00011     1.04005
   20    18 S   CT1  _CA2    20     1.46199   123.40381  -179.89532
   21    20 S   HC   _HA2    21     1.09733   109.39779    -9.42362
   22    20 S   C    _C2_    22     1.53440   108.36815  -125.04147
   23    22 S   O    _O2_    23     1.23021   122.22388  -145.67701
   24    20 S   CT   _CB2    32     1.53340   111.50025   112.65358
   25    24 S   HC   HB21    33     1.09661   109.99078    55.30653
   26    24 S   HC   HB22    34     1.09526   110.31175   173.99554
   27    22 S   N    _N3_    24     1.38504   113.41647    41.70531
   28    27 S   H    _HN3    25     1.01515   118.94956    -0.56821
   29    24 S   S    _SG2    35     1.82982   111.75443   -65.81812
   30    27 S   CT   _CA3    26     1.45445   123.40852   175.06330
   31    30 S   HC   HA31    27     1.09525   109.20961    25.15079
   32    30 S   HC   HA32    28     1.09495   107.13531   142.15357
   33    29 S   CA   _C12    36     1.79177    99.30655   169.54650
   34    30 S   CO3  _C3_    29     1.52924   113.10726   -98.30104
   35    34 S   O2Z  _O31    30     1.26402   115.39974   -44.64413
   36    34 S   O2Z  _O32    31     1.26353   114.98518   136.27869
   37    33 S   CA   _C11    37     1.40447   118.51044    68.08744
   38    37 S   HA   _H6_    38     1.09027   119.51879    -0.13848
   39    37 S   CA   _C10    39     1.40760   121.74006   179.95577
   40    39 S   CA   _C5_    40     1.47229   119.09901   179.37380
   41    39 S   CA   _C15    52     1.40494   118.14113    -0.59610
   42    41 S   Cl   Cl3_    53     1.73125   121.52285   179.93147
   43    40 S   CA   _C4_    41     1.40719   119.16161    90.99503
   44    43 S   HA   _H3_    42     1.08922   119.52112     0.10468
   45    41 S   CA   _C14    54     1.39776   120.75699     0.03956
   46    45 S   HA   _H7_    55     1.08832   119.84710  -179.97202
   47    43 S   CA   _C9_    43     1.39755   120.89027   179.98022
   48    47 S   Cl   Cl1_    44     1.72562   118.77884  -179.89532
   49    33 S   CA   _C13    56     1.40168   122.68433  -112.91502
   50    49 S   Cl   Cl4_    57     1.73106   122.34064     0.84580
   51    47 S   CA   _C8_    45     1.39374   119.94067     0.10279
   52    51 S   CA   _C7_    46     1.39421   120.23140     0.00000
   53    52 S   HA   _H4_    47     1.08727   120.10524   179.97202
   54    51 S   OH   _O33    50     1.36799   119.80203  -179.97202
   55    54 S   HO   _H5_    51     0.97236   109.02920   179.86152
   56    40 S   CA   _C6_    48     1.40841   122.61048   -88.81476
   57    56 S   Cl   Cl2_    49     1.73191   121.42500    -0.06256
  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   7   5   4   3
   9   2   1   1  10   4  12  12   7   3   8   4   3   2   7   3
   1   1   6   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    49    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    45    49    50  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    40    41    45    46    49    50  
   35    36  
   36  
    0  
   38    39    40    43    56    41    42    45    49    50  
   39    40    41    49  
   40    43    44    47    52    56    57    41    42    45    46    49  
   43    44    47    48    51    52    53    56    57    41    42    45  
   42    45    46    49    50    43    56  
   45    46    49  
   44    47    48    51    52    56    57    54  
   47    48    51    56  
   46    49    50  
   49    50  
   48    51    52    53    56    54    55  
   51    52    54  
   50  
    0  
   52    53    56    57    54    55  
   53    56    57    54    55  
   56    57    54  
   55    56  
    0  
   57  
    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  -0.320000   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   3.5500   0.0700   0.152500   2.5000   1.7750   0.001000000  -0.843144165
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   38   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   39   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   40   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   41   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   42   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   43   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   44   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   49   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   50   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   51   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   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   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   55   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   56   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   57   3.4000   0.3000  -0.180000   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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   250.000  1.760
   33    37   469.000  1.400
   33    49   469.000  1.400
   37    38   367.000  1.080
   37    39   469.000  1.400
   39    40   375.000  1.464
   39    41   469.000  1.400
   40    43   469.000  1.400
   40    56   469.000  1.400
   43    44   367.000  1.080
   43    47   469.000  1.400
   47    48   300.000  1.725
   47    51   469.000  1.400
   51    52   469.000  1.400
   51    54   450.000  1.364
   52    53   367.000  1.080
   52    56   469.000  1.400
   56    57   300.000  1.725
   54    55   553.000  0.945
   41    42   300.000  1.725
   41    45   469.000  1.400
   45    46   367.000  1.080
   45    49   469.000  1.400
   49    50   300.000  1.725
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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000  104.20000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    85.00000  119.40000
   29    33    49    85.00000  119.40000
   33    37    38    35.00000  120.00000
   33    37    39    63.00000  120.00000
   33    49    45    63.00000  120.00000
   33    49    50    75.00000  120.00000
   37    39    40    60.00000  122.76000
   37    39    41    63.00000  120.00000
   39    37    38    35.00000  120.00000
   39    40    43    60.00000  122.76000
   39    40    56    60.00000  122.76000
   39    41    42    75.00000  120.00000
   39    41    45    63.00000  120.00000
   40    43    44    35.00000  120.00000
   40    43    47    63.00000  120.00000
   40    56    52    63.00000  120.00000
   40    56    57    75.00000  120.00000
   43    47    48    75.00000  120.00000
   43    47    51    63.00000  120.00000
   47    43    44    35.00000  120.00000
   47    51    52    63.00000  120.00000
   47    51    54    70.00000  120.00000
   51    47    48    75.00000  120.00000
   51    52    53    35.00000  120.00000
   51    52    56    63.00000  120.00000
   51    54    55    35.00000  113.00000
   52    56    57    75.00000  120.00000
   56    40    43    63.00000  120.00000
   56    52    53    35.00000  120.00000
   54    51    52    70.00000  120.00000
   41    39    40    60.00000  122.76000
   41    45    46    35.00000  120.00000
   41    45    49    63.00000  120.00000
   45    41    42    75.00000  120.00000
   45    49    50    75.00000  120.00000
   49    33    37    63.00000  120.00000
   49    45    46    35.00000  120.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33  -0.35400  1.0 1.0
   20    24    29    33  -0.24450 -1.0 2.0
   20    24    29    33   0.44000  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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -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    34    35   0.00000  1.0 1.0
   27    30    34    36   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    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   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    37   0.63250 -1.0 2.0
   24    29    33    49   0.63250 -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    37    38   3.62500 -1.0 2.0
   29    33    37    39   3.62500 -1.0 2.0
   29    33    49    45   3.62500 -1.0 2.0
   29    33    49    50   3.62500 -1.0 2.0
   33    37    39    40   3.62500 -1.0 2.0
   33    37    39    41   3.62500 -1.0 2.0
   37    33    49    45   3.62500 -1.0 2.0
   37    33    49    50   3.62500 -1.0 2.0
   37    39    40    43  -0.19450  1.0 1.0
   37    39    40    43   0.63300 -1.0 2.0
   37    39    40    43   0.07450  1.0 3.0
   37    39    40    56  -0.19450  1.0 1.0
   37    39    40    56   0.63300 -1.0 2.0
   37    39    40    56   0.07450  1.0 3.0
   37    39    41    42   3.62500 -1.0 2.0
   37    39   -41    45   3.62500 -1.0 2.0
   38    37    39    40   3.62500 -1.0 2.0
   38    37    39    41   3.62500 -1.0 2.0
   39    40    43    44   3.62500 -1.0 2.0
   39    40    43    47   3.62500 -1.0 2.0
   39    40    56    52   3.62500 -1.0 2.0
   39    40    56    57   3.62500 -1.0 2.0
   39    41    45    46   3.62500 -1.0 2.0
   39    41    45    49   3.62500 -1.0 2.0
   40    39    41    42   3.62500 -1.0 2.0
   40    39    41    45   3.62500 -1.0 2.0
   40    43    47    48   3.62500 -1.0 2.0
   40    43    47    51   3.62500 -1.0 2.0
   43    40    56    52   3.62500 -1.0 2.0
   43    40    56    57   3.62500 -1.0 2.0
   43    47   -51    52   3.62500 -1.0 2.0
   43    47    51    54   3.62500 -1.0 2.0
   44    43    47    48   3.62500 -1.0 2.0
   44    43    47    51   3.62500 -1.0 2.0
   47    51    52    53   3.62500 -1.0 2.0
   47    51    52    56   3.62500 -1.0 2.0
   47    51    54    55   0.84100 -1.0 2.0
   48    47    51    52   3.62500 -1.0 2.0
   48    47    51    54   3.62500 -1.0 2.0
   51    52   -56    40   3.62500 -1.0 2.0
   51    52    56    57   3.62500 -1.0 2.0
   52    51    54    55   0.84100 -1.0 2.0
   53    52    56    40   3.62500 -1.0 2.0
   53    52    56    57   3.62500 -1.0 2.0
   56    40    43    44   3.62500 -1.0 2.0
   56    40   -43    47   3.62500 -1.0 2.0
   54    51    52    53   3.62500 -1.0 2.0
   54    51    52    56   3.62500 -1.0 2.0
   41    39    40    43  -0.19450  1.0 1.0
   41    39    40    43   0.63300 -1.0 2.0
   41    39    40    43   0.07450  1.0 3.0
   41    39    40    56  -0.19450  1.0 1.0
   41    39    40    56   0.63300 -1.0 2.0
   41    39    40    56   0.07450  1.0 3.0
   41    45   -49    33   3.62500 -1.0 2.0
   41    45    49    50   3.62500 -1.0 2.0
   42    41    45    46   3.62500 -1.0 2.0
   42    41    45    49   3.62500 -1.0 2.0
   46    45    49    33   3.62500 -1.0 2.0
   46    45    49    50   3.62500 -1.0 2.0
   49    33    37    38   3.62500 -1.0 2.0
   49    33   -37    39   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
   35    30    34    36  10.50000 -1.0 2.0
   37    49    33    29   4.00000 -1.0 2.0
   39    38    37    33   1.10000 -1.0 2.0
   40    41    39    37   4.00000 -1.0 2.0
   43    56    40    39   4.00000 -1.0 2.0
   47    44    43    40   1.10000 -1.0 2.0
   51    48    47    43   4.00000 -1.0 2.0
   52    54    51    47   4.00000 -1.0 2.0
   56    53    52    51   1.10000 -1.0 2.0
   52    57    56    40   4.00000 -1.0 2.0
   45    42    41    39   4.00000 -1.0 2.0
   49    46    45    41   1.10000 -1.0 2.0
   45    50    49    33   4.00000 -1.0 2.0
END
