* LIGAND DATABASE FILE (OPLS2005)
*
001      72    74    136    222     409
    1     0 S   NP   _N1_     1    29.19060    94.43745   -24.14213
    2     1 S   H    _HN1     2     1.02784   109.02314   -98.03310
    3     1 S   H    _H1_     3     1.02949    83.13939     9.06662
    4     1 S   H    _H2_     4     1.02832    25.30214   170.24958
    5     1 S   CT   _CA1     5     1.50099   128.77743   119.82492
    6     5 S   HC   _HA1     6     1.09571   105.21868    79.80791
    7     5 S   CO3  _C1_     7     1.53795   112.40245   -40.49260
    8     7 S   O2Z  _O11     8     1.26374   115.00300   -44.11586
    9     7 S   O2Z  _O12     9     1.26234   114.93956   135.04974
   10     5 S   CT   _CB1    10     1.53088   107.45588  -162.18314
   11    10 S   HC   HB11    11     1.09831   109.44224   -49.61127
   12    10 S   HC   HB12    12     1.09815   110.43729    67.01613
   13    10 S   CT   _CG1    13     1.53000   112.55935  -170.56731
   14    13 S   HC   HG11    14     1.09584   110.62688   -64.39159
   15    13 S   HC   HG12    15     1.09665   109.80814    54.84279
   16    13 S   C    _CD1    16     1.51783   112.22379   175.35548
   17    16 S   O    _OE1    17     1.22748   123.26407     6.31351
   18    16 S   N    _N2_    18     1.38667   111.68026  -173.99325
   19    18 S   H    _HN2    19     1.01588   119.00739     1.69189
   20    18 S   CT1  _CA2    20     1.46089   123.34971   178.24598
   21    20 S   HC   _HA2    21     1.09590   109.29194     0.34999
   22    20 S   C    _C2_    22     1.53519   108.89479  -114.69700
   23    22 S   O    _O2_    23     1.23058   122.20723  -149.56662
   24    20 S   CT   _CB2    32     1.53328   111.75889   122.71598
   25    24 S   HC   HB21    33     1.09651   109.69925    62.88174
   26    24 S   HC   HB22    34     1.09573   110.82646  -179.75772
   27    22 S   N    _N3_    24     1.38312   113.71085    38.00412
   28    27 S   H    _HN3    25     1.01593   119.56635    -3.67227
   29    24 S   S    _SG2    35     1.82903   114.68077   -57.05374
   30    27 S   CT   _CA3    26     1.45281   123.20580   176.94956
   31    30 S   HC   HA31    27     1.09550   107.54724   -63.56957
   32    30 S   HC   HA32    28     1.09557   107.94339    52.86343
   33    29 S   CT   _C18    36     1.82958    99.82271   -64.09434
   34    33 S   HC   _H3_    37     1.09451   108.28401   -50.78892
   35    33 S   HC   _H4_    38     1.09296   107.21439    66.81886
   36    30 S   CO3  _C3_    29     1.52954   114.07371   174.83043
   37    36 S   O2Z  _O31    30     1.26377   116.05619    -0.62307
   38    36 S   O2Z  _O32    31     1.26426   114.41568   179.43214
   39    33 S   CT   _C13    39     1.53804   111.23525  -173.48200
   40    39 S   HC   _H32    40     1.09804   108.59620   -37.78246
   41    39 S   CO4  _C6_    41     1.52498   112.00854    80.79876
   42    41 S   O    _O17    42     1.22516   124.43675   -17.27135
   43    41 S   OS   _O19    43     1.36276   113.98598   160.53261
   44    43 S   CT   _C11    44     1.43953   118.07288    25.38333
   45    44 S   HC   _H29    45     1.09564   106.96390   178.84157
   46    44 S   HC   _H30    46     1.09599   105.26287    66.28064
   47    44 S   CT   _C17    47     1.55656   113.86607   -57.62586
   48    47 S   CT   _C10    48     1.55485   110.50959  -104.00904
   49    48 S   HC   _H27    49     1.09835   111.13167   -45.81444
   50    48 S   HC   _H28    50     1.10001   110.93913  -161.72023
   51    47 S   CM   _C9_    68     1.53762   111.26779   140.16276
   52    51 S   HC   _H26    69     1.09015   115.88874  -158.38421
   53    48 S   CT   _C15    51     1.51355   111.56036    76.90889
   54    53 S   HC   _H34    52     1.09966   109.61833   -60.65867
   55    51 S   CM   _C8_    70     1.33983   128.06704    24.50718
   56    55 S   HC   _H24    71     1.08559   120.03386   178.71854
   57    55 S   HC   _H25    72     1.08332   122.84594     0.07402
   58    53 S   CT   _C12    53     1.50859   108.85487    63.21625
   59    58 S   HC   _H31    54     1.10052   111.28969    51.63550
   60    58 S   CM   _C4_    55     1.48772    97.65137   162.41094
   61    58 S   CT   _C16    62     1.52048   109.49168   -69.48085
   62    61 S   HC   _H35    63     1.09462   109.31956   -66.82770
   63    60 S   CO4  _C5_    56     1.48787   106.40963   -32.31235
   64    63 S   O    _O16    57     1.21689   127.21442  -165.11467
   65    60 S   CM   _C7_    59     1.33418   131.03199   145.57543
   66    65 S   HC   _H22    60     1.08442   121.21533     1.26347
   67    65 S   HC   _H23    61     1.08525   121.48950  -178.79585
   68    39 S   CT   _C14    64     1.56192   112.28302  -158.10999
   69    68 S   HC   _H33    65     1.10014   106.92948    52.56018
   70    61 S   OH   _O20    66     1.42917   108.69832   177.28430
   71    70 S   HO   _H38    67     0.97272   108.31486   -59.67792
   72    53 S   OS   _O18    58     1.42899   113.62603   179.39219
  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   7   5   4   3
  11   5   4   2   1   1  14   7   9   3   7  13   5   4  17  15
   7   6   8   4  12   6   3   1   1  14   8  10   8   4   5   2
   3   1   1   3   1   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    68  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    47    61    68    69  
   35    39    40    41    68  
   39    40    41    68  
   37    38  
   38  
    0  
   40    41    42    43    44    47    48    58    61    62    68    69    70    51  
   41    42    43    47    61    68    69  
   42    43    44    45    46    47    61    68    69  
   43    44    68  
   44    45    46    47    48    68    51  
   45    46    47    48    49    50    53    61    68    69    51    52    55  
   46    47    48    68    51  
   47    48    68    51  
   48    49    50    53    54    58    72    61    62    68    69    70    51    52    55    56    57  
   49    50    53    54    58    59    60    63    72    61    68    69    51    52    55  
   50    53    54    58    72    68    51  
   53    54    58    72    68    51  
   52    55    56    57    53    61    68    69  
   55    56    57    68  
   54    58    59    60    63    64    72    65    61    62    68    70  
   58    59    60    63    72    61  
   56    57    68  
   57  
    0  
   59    60    63    64    72    65    66    67    61    62    68    69    70    71  
   60    63    72    65    61    62    68    70  
   63    64    72    65    66    67    61    62    68    70  
   62    68    69    70    71    63    65    72  
   68    69    70    71  
   64    72    65    66    67  
   72    65  
   66    67    72  
   67  
    0  
   69    70    71  
   70  
   71  
    0  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   44   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   46   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   47   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   48   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   52   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   55   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   61   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   64   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   65   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   66   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   67   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   71   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   72   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   317.000  1.522
   39    68   268.000  1.529
   41    42   570.000  1.229
   41    43   214.000  1.327
   43    44   320.000  1.410
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   268.000  1.529
   47    48   268.000  1.529
   47    68   268.000  1.529
   47    51   317.000  1.510
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    53   268.000  1.529
   53    54   340.000  1.090
   53    58   268.000  1.529
   53    72   320.000  1.410
   58    59   340.000  1.090
   58    60   317.000  1.510
   58    61   268.000  1.529
   60    63   320.000  1.462
   60    65   549.000  1.340
   63    64   570.000  1.229
   63    72   214.000  1.327
   65    66   340.000  1.080
   65    67   340.000  1.080
   61    62   340.000  1.090
   61    68   268.000  1.529
   61    70   320.000  1.410
   68    69   340.000  1.090
   70    71   553.000  0.945
   51    52   340.000  1.080
   51    55   549.000  1.340
   55    56   340.000  1.080
   55    57   340.000  1.080
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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    63.00000  111.10000
   33    39    68    58.35000  112.70000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    80.00000  120.40000
   39    41    43    81.00000  111.40000
   39    68    47    58.35000  112.70000
   39    68    61    58.35000  112.70000
   39    68    69    37.50000  110.70000
   41    39    40    35.00000  109.50000
   41    43    44    83.00000  116.90000
   43    41    42    83.00000  123.40000
   43    44    45    35.00000  109.50000
   43    44    46    35.00000  109.50000
   43    44    47    50.00000  109.50000
   44    47    48    58.35000  112.70000
   44    47    68    58.35000  112.70000
   44    47    51    70.00000  112.02700
   46    44    45    33.00000  107.80000
   47    44    45    37.50000  110.70000
   47    44    46    37.50000  110.70000
   47    48    49    37.50000  110.70000
   47    48    50    37.50000  110.70000
   47    48    53    58.35000  112.70000
   47    68    61    58.35000  112.70000
   47    68    69    37.50000  110.70000
   47    51    52    35.00000  117.00000
   47    51    55    70.00000  124.00000
   48    53    54    37.50000  110.70000
   48    53    58    58.35000  112.70000
   48    53    72    50.00000  109.50000
   50    48    49    33.00000  107.80000
   53    48    49    37.50000  110.70000
   53    48    50    37.50000  110.70000
   53    58    59    37.50000  110.70000
   53    58    60    70.00000  112.02700
   53    58    61    58.35000  112.70000
   53    72    63    83.00000  116.90000
   58    53    54    37.50000  110.70000
   58    60    63    65.00000  116.34900
   58    60    65    70.00000  124.00000
   58    61    62    37.50000  110.70000
   58    61    68    58.35000  112.70000
   58    61    70    50.00000  109.50000
   60    58    59    35.00000  109.50000
   60    63    64    80.00000  123.72100
   60    63    72    90.00000  111.29400
   60    65    66    35.00000  120.00000
   60    65    67    35.00000  120.00000
   72    53    54    35.00000  109.50000
   72    53    58    50.00000  109.50000
   72    63    64    83.00000  123.40000
   65    60    63    65.00000  118.96000
   67    65    66    35.00000  117.00000
   61    58    59    37.50000  110.70000
   61    58    60    70.00000  112.02700
   61    68    69    37.50000  110.70000
   61    70    71    55.00000  108.50000
   68    39    40    37.50000  110.70000
   68    39    41    63.00000  111.10000
   68    47    48    58.35000  112.70000
   68    61    62    37.50000  110.70000
   70    61    62    35.00000  109.50000
   70    61    68    50.00000  109.50000
   51    47    48    70.00000  112.02700
   51    47    68    70.00000  112.02700
   51    55    56    35.00000  120.00000
   51    55    57    35.00000  120.00000
   55    51    52    35.00000  120.00000
   57    55    56    35.00000  117.00000
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   0.01700  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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    35   0.32350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   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    39    40   0.15000  1.0 3.0
   29    33    39    41   0.56750  1.0 1.0
   29    33    39    41  -0.07550 -1.0 2.0
   29    33    39    41   0.20000  1.0 3.0
   29    33    39    68   0.44750  1.0 1.0
   29    33    39    68  -0.17800 -1.0 2.0
   29    33    39    68   0.20200  1.0 3.0
   33    39    41    42   0.30150 -1.0 2.0
   33    39    41    43   0.36750  1.0 3.0
   33    39    68    47   0.56750  1.0 1.0
   33    39    68    47  -0.07550 -1.0 2.0
   33    39    68    47   0.20000  1.0 3.0
   33    39    68    61   0.56750  1.0 1.0
   33    39    68    61  -0.07550 -1.0 2.0
   33    39    68    61   0.20000  1.0 3.0
   33    39    68    69   0.15000  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41  -0.11250  1.0 3.0
   34    33    39    68   0.15000  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41  -0.11250  1.0 3.0
   35    33    39    68   0.15000  1.0 3.0
   39    41    43    44   1.63150  1.0 1.0
   39    41    43    44   2.92000 -1.0 2.0
   40    39    41    42   0.00000  1.0 1.0
   40    39    41    43   0.00000  1.0 1.0
   40    39    68    47   0.15000  1.0 3.0
   40    39    68    61   0.15000  1.0 3.0
   40    39    68    69   0.15000  1.0 3.0
   41    39    68    47  -0.95700  1.0 1.0
   41    39    68    47  -0.18200 -1.0 2.0
   41    39    68    47   0.29450  1.0 3.0
   41    39    68    61  -0.95700  1.0 1.0
   41    39    68    61  -0.18200 -1.0 2.0
   41    39    68    61   0.29450  1.0 3.0
   41    39    68    69  -0.11250  1.0 3.0
   41    43    44    45   0.08050  1.0 3.0
   41    43    44    46   0.08050  1.0 3.0
   41    43   -44    47  -0.25900  1.0 1.0
   41    43   -44    47  -0.47000 -1.0 2.0
   41    43   -44    47   0.11750  1.0 3.0
   42    41    43    44   3.00000 -1.0 2.0
   43    44    47    48   0.62750  1.0 1.0
   43    44    47    48  -0.30950 -1.0 2.0
   43    44    47    48   0.27300  1.0 3.0
   43    44    47    68   0.62750  1.0 1.0
   43    44    47    68  -0.30950 -1.0 2.0
   43    44    47    68   0.27300  1.0 3.0
   43    44    47    51   0.61850  1.0 1.0
   43    44    47    51  -0.22750 -1.0 2.0
   43    44    47    51   0.15300  1.0 3.0
   44    47    48    49   0.15000  1.0 3.0
   44    47    48    50   0.15000  1.0 3.0
   44    47    48    53   0.56750  1.0 1.0
   44    47    48    53  -0.07550 -1.0 2.0
   44    47    48    53   0.20000  1.0 3.0
   44    47   -68    39   0.56750  1.0 1.0
   44    47   -68    39  -0.07550 -1.0 2.0
   44    47   -68    39   0.20000  1.0 3.0
   44    47    68    61   0.56750  1.0 1.0
   44    47    68    61  -0.07550 -1.0 2.0
   44    47    68    61   0.20000  1.0 3.0
   44    47    68    69   0.15000  1.0 3.0
   44    47    51    52   0.00000  1.0 1.0
   44    47    51    55   0.09850  1.0 1.0
   44    47    51    55   0.15250 -1.0 2.0
   44    47    51    55  -0.50650  1.0 3.0
   45    44    47    48   0.15000  1.0 3.0
   45    44    47    68   0.15000  1.0 3.0
   45    44    47    51   0.15000  1.0 3.0
   46    44    47    48   0.15000  1.0 3.0
   46    44    47    68   0.15000  1.0 3.0
   46    44    47    51   0.15000  1.0 3.0
   47    48    53    54   0.15000  1.0 3.0
   47    48    53    58   0.56750  1.0 1.0
   47    48    53    58  -0.07550 -1.0 2.0
   47    48    53    58   0.20000  1.0 3.0
   47    48    53    72   0.62750  1.0 1.0
   47    48    53    72  -0.30950 -1.0 2.0
   47    48    53    72   0.27300  1.0 3.0
   47    51    55    56   7.00000 -1.0 2.0
   47    51    55    57   7.00000 -1.0 2.0
   48    47    68    39   0.56750  1.0 1.0
   48    47    68    39  -0.07550 -1.0 2.0
   48    47    68    39   0.20000  1.0 3.0
   48    47    68    61   0.56750  1.0 1.0
   48    47    68    61  -0.07550 -1.0 2.0
   48    47    68    61   0.20000  1.0 3.0
   48    47    68    69   0.15000  1.0 3.0
   48    47    51    52   0.00000  1.0 1.0
   48    47    51    55   0.09850  1.0 1.0
   48    47    51    55   0.15250 -1.0 2.0
   48    47    51    55  -0.50650  1.0 3.0
   48    53    58    59   0.15000  1.0 3.0
   48    53    58    60   0.34400  1.0 1.0
   48    53    58    60   0.09450 -1.0 2.0
   48    53    58    60   0.11100  1.0 3.0
   48    53   -58    61   0.56750  1.0 1.0
   48    53   -58    61  -0.07550 -1.0 2.0
   48    53   -58    61   0.20000  1.0 3.0
   48    53    72    63  -0.25900  1.0 1.0
   48    53    72    63  -0.47000 -1.0 2.0
   48    53    72    63   0.11750  1.0 3.0
   49    48    53    54   0.15000  1.0 3.0
   49    48    53    58   0.15000  1.0 3.0
   49    48    53    72   0.23400  1.0 3.0
   50    48    53    54   0.15000  1.0 3.0
   50    48    53    58   0.15000  1.0 3.0
   50    48    53    72   0.23400  1.0 3.0
   53    58   -60    63   0.09700  1.0 1.0
   53    58   -60    63   0.15600 -1.0 2.0
   53    58   -60    63  -0.50800  1.0 3.0
   53    58    60    65   0.09850  1.0 1.0
   53    58    60    65   0.15250 -1.0 2.0
   53    58    60    65  -0.50650  1.0 3.0
   53    58    61    62   0.15000  1.0 3.0
   53    58    61    68   0.56750  1.0 1.0
   53    58    61    68  -0.07550 -1.0 2.0
   53    58    61    68   0.20000  1.0 3.0
   53    58    61    70   0.86500  1.0 1.0
   53    58    61    70  -0.17500 -1.0 2.0
   53    58    61    70   0.20800  1.0 3.0
   54    53    58    59   0.15000  1.0 3.0
   54    53    58    60   0.15000  1.0 3.0
   54    53    58    61   0.15000  1.0 3.0
   54    53    72    63   0.08050  1.0 3.0
   58    53   -72    63  -0.25900  1.0 1.0
   58    53   -72    63  -0.47000 -1.0 2.0
   58    53   -72    63   0.11750  1.0 3.0
   58    60    63    64  -0.64400  1.0 1.0
   58    60    63    64   0.26850 -1.0 2.0
   58    60   -63    72  -0.15000  1.0 1.0
   58    60   -63    72   0.89550 -1.0 2.0
   58    60   -63    72  -0.06900  1.0 3.0
   58    60    65    66   7.00000 -1.0 2.0
   58    60    65    67   7.00000 -1.0 2.0
   58    61    68    39   0.56750  1.0 1.0
   58    61    68    39  -0.07550 -1.0 2.0
   58    61    68    39   0.20000  1.0 3.0
   58    61   -68    47   0.56750  1.0 1.0
   58    61   -68    47  -0.07550 -1.0 2.0
   58    61   -68    47   0.20000  1.0 3.0
   58    61    68    69   0.15000  1.0 3.0
   58    61    70    71  -0.11600  1.0 1.0
   58    61    70    71  -0.09450 -1.0 2.0
   58    61    70    71   0.21250  1.0 3.0
   59    58    60    63   0.15000  1.0 3.0
   59    58    60    65   0.00000  1.0 1.0
   59    58    61    62   0.15000  1.0 3.0
   59    58    61    68   0.15000  1.0 3.0
   59    58    61    70   0.23400  1.0 3.0
   60    58    61    62   0.15000  1.0 3.0
   60    58    61    68   0.34400  1.0 1.0
   60    58    61    68   0.09450 -1.0 2.0
   60    58    61    68   0.11100  1.0 3.0
   60    58    61    70   1.05650  1.0 1.0
   60    58    61    70   0.15600 -1.0 2.0
   60    58    61    70   0.53150  1.0 3.0
   60    63   -72    53   2.00000 -1.0 2.0
   63    60    65    66   7.00000 -1.0 2.0
   63    60    65    67   7.00000 -1.0 2.0
   64    63    72    53   3.00000 -1.0 2.0
   72    53    58    59   0.23400  1.0 3.0
   72    53   -58    60   0.61850  1.0 1.0
   72    53   -58    60  -0.22750 -1.0 2.0
   72    53   -58    60   0.15300  1.0 3.0
   72    53    58    61   0.62750  1.0 1.0
   72    53    58    61  -0.30950 -1.0 2.0
   72    53    58    61   0.27300  1.0 3.0
   65    60    63    64   1.00000 -1.0 2.0
   65    60    63    72  -0.56150  1.0 1.0
   65    60    63    72   2.19150 -1.0 2.0
   61    58    60    63   0.09700  1.0 1.0
   61    58    60    63   0.15600 -1.0 2.0
   61    58    60    63  -0.50800  1.0 3.0
   61    58    60    65   0.09850  1.0 1.0
   61    58    60    65   0.15250 -1.0 2.0
   61    58    60    65  -0.50650  1.0 3.0
   62    61    68    39   0.15000  1.0 3.0
   62    61    68    47   0.15000  1.0 3.0
   62    61    68    69   0.15000  1.0 3.0
   62    61    70    71   0.19450  1.0 3.0
   68    39    41    42   0.30150 -1.0 2.0
   68    39   -41    43   0.36750  1.0 3.0
   68    47    48    49   0.15000  1.0 3.0
   68    47    48    50   0.15000  1.0 3.0
   68    47   -48    53   0.56750  1.0 1.0
   68    47   -48    53  -0.07550 -1.0 2.0
   68    47   -48    53   0.20000  1.0 3.0
   68    47    51    52   0.00000  1.0 1.0
   68    47    51    55   0.09850  1.0 1.0
   68    47    51    55   0.15250 -1.0 2.0
   68    47    51    55  -0.50650  1.0 3.0
   68    61    70    71  -0.11600  1.0 1.0
   68    61    70    71  -0.09450 -1.0 2.0
   68    61    70    71   0.21250  1.0 3.0
   70    61    68    39   0.86500  1.0 1.0
   70    61    68    39  -0.17500 -1.0 2.0
   70    61    68    39   0.20800  1.0 3.0
   70    61    68    47   0.86500  1.0 1.0
   70    61    68    47  -0.17500 -1.0 2.0
   70    61    68    47   0.20800  1.0 3.0
   70    61    68    69   0.23400  1.0 3.0
   51    47    48    49   0.15000  1.0 3.0
   51    47    48    50   0.15000  1.0 3.0
   51    47    48    53   0.34400  1.0 1.0
   51    47    48    53   0.09450 -1.0 2.0
   51    47    48    53   0.11100  1.0 3.0
   51    47    68    39   0.34400  1.0 1.0
   51    47    68    39   0.09450 -1.0 2.0
   51    47    68    39   0.11100  1.0 3.0
   51    47    68    61   0.34400  1.0 1.0
   51    47    68    61   0.09450 -1.0 2.0
   51    47    68    61   0.11100  1.0 3.0
   51    47    68    69   0.15000  1.0 3.0
   52    51    55    56   7.00000 -1.0 2.0
   52    51    55    57   7.00000 -1.0 2.0
IPHI
    9     5     7     8  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
   38    30    36    37  10.50000 -1.0 2.0
   39    43    41    42  10.50000 -1.0 2.0
   58    63    60    65   1.10000 -1.0 2.0
   60    72    63    64  10.50000 -1.0 2.0
   66    67    65    60   1.10000 -1.0 2.0
   47    52    51    55  15.00000 -1.0 2.0
   56    57    55    51  15.00000 -1.0 2.0
END
