* LIGAND DATABASE FILE (OPLS2005)
*
001      63    63    110    158     317
    1     0 S   NP   _N1_     1    28.73080    97.35398   -23.13002
    2     1 S   H    _HN1     2     1.02950    65.49543    28.00911
    3     1 S   H    _H1_     3     1.02831    47.53597   176.75659
    4     1 S   H    _H2_     4     1.02784    99.69947   -77.83297
    5     1 S   CT   _CA1     5     1.50109   146.79832   118.21766
    6     5 S   HC   _HA1     6     1.09574   105.21199   101.52232
    7     5 S   CO3  _C1_     7     1.53779   112.40064   -18.71846
    8     7 S   O2Z  _O11     8     1.26367   115.00422   -44.08914
    9     7 S   O2Z  _O12     9     1.26236   114.94198   135.03054
   10     5 S   CT   _CB1    10     1.53083   107.42655  -140.53047
   11    10 S   HC   HB11    11     1.09831   109.36585   -50.16367
   12    10 S   HC   HB12    12     1.09813   110.45163    66.42974
   13    10 S   CT   _CG1    13     1.52996   112.60720  -171.16389
   14    13 S   HC   HG11    14     1.09586   110.59592   -65.05868
   15    13 S   HC   HG12    15     1.09669   109.82272    54.17020
   16    13 S   C    _CD1    16     1.51807   112.24989   174.59568
   17    16 S   O    _OE1    17     1.22731   123.29642     5.08377
   18    16 S   N    _N2_    18     1.38652   111.66792  -174.96184
   19    18 S   H    _HN2    19     1.01597   118.96261     1.67421
   20    18 S   CT1  _CA2    20     1.46182   123.38706   177.57715
   21    20 S   HC   _HA2    21     1.09732   109.35693     1.55922
   22    20 S   C    _C2_    22     1.53572   108.75885  -113.95074
   23    22 S   O    _O2_    23     1.23068   122.26464  -149.22700
   24    20 S   CT   _CB2    32     1.53263   111.57287   123.58673
   25    24 S   HC   HB21    33     1.09587   109.90795    55.87518
   26    24 S   HC   HB22    34     1.09546   110.03572   174.87298
   27    22 S   N    _N3_    24     1.38323   113.71961    38.31813
   28    27 S   H    _HN3    25     1.01589   119.56949    -3.56782
   29    24 S   S    _SG2    35     1.83079   111.60360   -65.12933
   30    27 S   CT   _CA3    26     1.45288   123.20990   177.08436
   31    30 S   HC   HA31    27     1.09550   107.53060   -63.97128
   32    30 S   HC   HA32    28     1.09557   107.96014    52.46509
   33    29 S   CQ   _C8_    36     1.78504   101.14568  -179.95577
   34    30 S   CO3  _C3_    29     1.52959   114.07489   174.43345
   35    34 S   O2Z  _O31    30     1.26382   116.05607    -0.96266
   36    34 S   O2Z  _O32    31     1.26430   114.42114   179.09000
   37    33 S   NB   _N7_    37     1.33957   116.13113   178.73514
   38    37 S   CQ   _C6_    38     1.34284   115.97483  -179.90721
   39    38 S   NB   _N5_    39     1.34600   122.80988     0.03426
   40    38 S   NE   _N4_    55     1.38318   120.28750  -179.98022
   41    40 S   H    _H8_    56     1.01198   117.41436   179.94065
   42    39 S   CQ   _C7_    40     1.34540   117.61903    -0.06561
   43    40 S   CT   _C5_    57     1.44617   121.68066     0.14265
   44    43 S   HC   _H6_    58     1.09609   110.24606   -59.68639
   45    43 S   HC   _H7_    59     1.09609   110.24342    59.69380
   46    33 S   NB   _N6_    41     1.33915   119.16719    -1.19485
   47    42 S   NE   _N8_    42     1.38297   116.58837  -179.93744
   48    47 S   H    _H9_    43     1.01388   114.95960    -2.05852
   49    43 S   CT   _C4_    60     1.51955   109.94217  -180.00000
   50    49 S   HC   _H3_    61     1.09523   111.01117   -59.94025
   51    49 S   HC   _H4_    62     1.09523   111.01176    59.95115
   52    49 S   HC   _H5_    63     1.09435   110.41228  -180.00000
   53    47 S   CT   _C9_    44     1.46289   126.13126  -177.93228
   54    53 S   CZ   _C12    45     1.48053   111.99654   -55.93992
   55    54 S   NZ   _N9_    46     1.16096   179.56659  -144.50043
   56    53 S   CT   _C10    47     1.54074   107.38683  -174.49370
   57    56 S   HC   _H10    48     1.09655   111.27348   -59.53391
   58    56 S   HC   _H11    49     1.09722   111.26271    60.04150
   59    56 S   HC   _H12    50     1.09660   111.52823   179.97202
   60    53 S   CT   _C11    51     1.53523   110.26064    67.53728
   61    60 S   HC   _H13    52     1.09631   111.18726    54.29142
   62    60 S   HC   _H14    53     1.09543   112.20888   -65.92870
   63    60 S   HC   _H15    54     1.09670   111.23005   174.52192
  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   5   5   4   3
   7   2   1   1   7  10   8   9   4   7   6   5   4   3  12   4
   3   2   1   1  10   9   2   7   3   2   1   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    46    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    42    46  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    42    46    47    40  
   35    36  
   36  
    0  
   38    39    42    46    40    41    43  
   39    42    46    47    40    41    43    44    45    49  
   42    46    47    48    53    40    41    43  
   41    43    44    45    49    50    51    52    42  
   43    44    45    49  
   46    47    48    53    54    56    60  
   44    45    49    50    51    52  
   45    49    50    51    52  
   49    50    51    52  
   47    48    53  
   48    53    54    55    56    57    58    59    60    61    62    63  
   53    54    56    60  
   50    51    52  
   51    52  
   52  
    0  
   54    55    56    57    58    59    60    61    62    63  
   55    56    57    58    59    60    61    62    63  
   56    60  
   57    58    59    60    61    62    63  
   58    59    60  
   59    60  
   60  
   61    62    63  
   62    63  
   63  
    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   1.078700   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   3.2800   0.1700  -0.926200   1.8000   1.6000   0.001000000  -0.511443539
   38   3.5500   0.0700   1.126200   2.0020   1.7750   0.001000000  -0.843144165
   39   3.2800   0.1700  -0.926200   1.8000   1.6000   0.001000000  -0.511443539
   40   3.3000   0.1700  -0.780000   1.8650   1.6500   0.051222218  -2.220205820
   41   0.5000   0.0300   0.380000   0.9960   0.8600   0.030040813  -0.651083722
   42   3.5500   0.0700   1.126200   2.0020   1.7750   0.001000000  -0.843144165
   43   3.5000   0.0660   0.080000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.2800   0.1700  -0.926200   1.8000   1.6000   0.001000000  -0.511443539
   47   3.3000   0.1700  -0.702500   1.8650   1.6500   0.051222218  -2.220205820
   48   0.5000   0.0300   0.380000   0.9960   0.8600   0.030040813  -0.651083722
   49   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.3000   0.0660   0.222500   1.9750   1.7500   0.005000000  -0.741685710
   54   3.3000   0.0660   0.460000   2.0580   1.8250   0.025318638  -1.264311570
   55   3.2800   0.1700  -0.560000   2.2500   2.0000   0.024786691  -1.117108600
   56   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   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    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   225.000  1.774
   33    37   502.000  1.324
   33    46   502.000  1.324
   37    38   502.000  1.324
   38    39   502.000  1.324
   38    40   410.000  1.375
   39    42   502.000  1.324
   42    46   502.000  1.324
   42    47   410.000  1.375
   47    48   434.000  1.010
   47    53   382.000  1.448
   53    54   390.000  1.470
   53    56   268.000  1.529
   53    60   268.000  1.529
   54    55   650.000  1.157
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   340.000  1.090
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   340.000  1.090
   40    41   434.000  1.010
   40    43   382.000  1.448
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    49   268.000  1.529
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   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    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    80.00000   99.04000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    80.00000  114.04000
   29    33    46    80.00000  114.04000
   33    37    38    85.00000  113.71000
   33    46    42    85.00000  113.71000
   37    38    39    70.00000  129.10000
   37    38    40    85.00000  116.09700
   38    39    42    85.00000  113.71000
   38    40    41    50.00000  113.31100
   38    40    43    50.00000  123.00000
   39    42    46    70.00000  129.10000
   39    42    47    85.00000  116.09700
   42    47    48    50.00000  113.31100
   42    47    53    50.00000  123.00000
   46    33    37    70.00000  129.10000
   47    42    46    85.00000  116.09700
   47    53    54    80.00000  110.69000
   47    53    56    80.00000  111.61500
   47    53    60    80.00000  111.61500
   53    47    48    35.00000  112.50000
   53    54    55   150.00000  180.00000
   53    56    57    37.50000  110.70000
   53    56    58    37.50000  110.70000
   53    56    59    37.50000  110.70000
   53    60    61    37.50000  110.70000
   53    60    62    37.50000  110.70000
   53    60    63    37.50000  110.70000
   56    53    54    58.35000  112.70000
   58    56    57    33.00000  107.80000
   59    56    57    33.00000  107.80000
   59    56    58    33.00000  107.80000
   60    53    54    58.35000  112.70000
   60    53    56    58.35000  112.70000
   62    60    61    33.00000  107.80000
   63    60    61    33.00000  107.80000
   63    60    62    33.00000  107.80000
   40    38    39    85.00000  116.09700
   40    43    44    35.00000  109.50000
   40    43    45    35.00000  109.50000
   40    43    49    80.00000  111.61500
   43    40    41    35.00000  112.50000
   43    49    50    37.50000  110.70000
   43    49    51    37.50000  110.70000
   43    49    52    37.50000  110.70000
   45    43    44    33.00000  107.80000
   49    43    44    37.50000  110.70000
   49    43    45    37.50000  110.70000
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    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  -0.35400  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   0.63150 -1.0 2.0
   24    29    33    46   0.63150 -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    46    42   3.62500 -1.0 2.0
   33    37    38    39   3.62500 -1.0 2.0
   33    37    38    40   3.62500 -1.0 2.0
   37    33    46    42   3.62500 -1.0 2.0
   37    38   -39    42   3.62500 -1.0 2.0
   37    38    40    41   1.75000 -1.0 2.0
   37    38    40    43  -1.10000  1.0 1.0
   37    38    40    43   1.25000 -1.0 2.0
   38    39    42    46   3.62500 -1.0 2.0
   38    39    42    47   3.62500 -1.0 2.0
   38    40    43    44   0.00000  1.0 1.0
   38    40    43    45   0.00000  1.0 1.0
   38    40    43    49   0.92500  1.0 1.0
   38    40    43    49   0.12150 -1.0 2.0
   38    40    43    49  -0.25000  1.0 3.0
   39    38    40    41   1.75000 -1.0 2.0
   39    38    40    43  -1.10000  1.0 1.0
   39    38    40    43   1.25000 -1.0 2.0
   39    42   -46    33   3.62500 -1.0 2.0
   39    42    47    48   1.75000 -1.0 2.0
   39    42    47    53  -1.10000  1.0 1.0
   39    42    47    53   1.25000 -1.0 2.0
   42    47    53    54  -0.12500  1.0 1.0
   42    47    53    54  -0.12500 -1.0 2.0
   42    47    53    54   0.25000  1.0 3.0
   42    47    53    56   0.92500  1.0 1.0
   42    47    53    56   0.12150 -1.0 2.0
   42    47    53    56  -0.25000  1.0 3.0
   42    47    53    60   0.92500  1.0 1.0
   42    47    53    60   0.12150 -1.0 2.0
   42    47    53    60  -0.25000  1.0 3.0
   46    33   -37    38   3.62500 -1.0 2.0
   46    42    47    48   1.75000 -1.0 2.0
   46    42    47    53  -1.10000  1.0 1.0
   46    42    47    53   1.25000 -1.0 2.0
   47    42    46    33   3.62500 -1.0 2.0
   47    53    54    55   0.00000  1.0 1.0
   47    53    56    57   0.22950  1.0 3.0
   47    53    56    58   0.22950  1.0 3.0
   47    53    56    59   0.22950  1.0 3.0
   47    53    60    61   0.22950  1.0 3.0
   47    53    60    62   0.22950  1.0 3.0
   47    53    60    63   0.22950  1.0 3.0
   48    47    53    54  -0.12500  1.0 1.0
   48    47    53    54  -0.12500 -1.0 2.0
   48    47    53    54   0.25000  1.0 3.0
   48    47    53    56   0.00000  1.0 1.0
   48    47    53    60   0.00000  1.0 1.0
   54    53    56    57   0.15000  1.0 3.0
   54    53    56    58   0.15000  1.0 3.0
   54    53    56    59   0.15000  1.0 3.0
   54    53    60    61   0.15000  1.0 3.0
   54    53    60    62   0.15000  1.0 3.0
   54    53    60    63   0.15000  1.0 3.0
   56    53    54    55   0.00000  1.0 1.0
   56    53    60    61   0.15000  1.0 3.0
   56    53    60    62   0.15000  1.0 3.0
   56    53    60    63   0.15000  1.0 3.0
   60    53    54    55   0.00000  1.0 1.0
   60    53    56    57   0.15000  1.0 3.0
   60    53    56    58   0.15000  1.0 3.0
   60    53    56    59   0.15000  1.0 3.0
   40    38    39    42   3.62500 -1.0 2.0
   40    43    49    50   0.22950  1.0 3.0
   40    43    49    51   0.22950  1.0 3.0
   40    43    49    52   0.22950  1.0 3.0
   41    40    43    44   0.00000  1.0 1.0
   41    40    43    45   0.00000  1.0 1.0
   41    40    43    49   0.00000  1.0 1.0
   44    43    49    50   0.15000  1.0 3.0
   44    43    49    51   0.15000  1.0 3.0
   44    43    49    52   0.15000  1.0 3.0
   45    43    49    50   0.15000  1.0 3.0
   45    43    49    51   0.15000  1.0 3.0
   45    43    49    52   0.15000  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
   35    30    34    36  10.50000 -1.0 2.0
   37    46    33    29   4.00000 -1.0 2.0
   39    40    38    37   4.00000 -1.0 2.0
   46    47    42    39   4.00000 -1.0 2.0
   48    42    47    53   1.00000 -1.0 2.0
   41    38    40    43   1.00000 -1.0 2.0
END
