* LIGAND DATABASE FILE (OPLS2005)
*
001      72    72    129    198     387
    1     0 S   NP   _N1_     1    30.46373    98.23233   -18.45964
    2     1 S   H    _HN1     2     1.02944    58.82918     7.67598
    3     1 S   H    _H1_     3     1.02822    64.62740   139.57838
    4     1 S   H    _H2_     4     1.02785    84.56615  -107.67207
    5     1 S   CT   _CA1     5     1.50128   162.99441    61.90106
    6     5 S   HC   _HA1     6     1.09563   105.19815   130.03664
    7     5 S   CO3  _C1_     7     1.53854   112.30349     9.65657
    8     7 S   O2Z  _O11     8     1.26409   114.96020   -43.29126
    9     7 S   O2Z  _O12     9     1.26201   115.02329   135.59217
   10     5 S   CT   _CB1    10     1.53068   107.40812  -111.76404
   11    10 S   HC   HB11    11     1.09834   109.72420   -46.65876
   12    10 S   HC   HB12    12     1.09807   110.37762    70.08780
   13    10 S   CT   _CG1    13     1.52945   112.40803  -167.41550
   14    13 S   HC   HG11    14     1.09546   110.71915   -62.88923
   15    13 S   HC   HG12    15     1.09667   109.67490    56.17986
   16    13 S   C    _CD1    16     1.51833   112.01777   177.03067
   17    16 S   O    _OE1    17     1.22748   123.21059    14.52064
   18    16 S   N    _N2_    18     1.38375   111.74942  -166.56287
   19    18 S   H    _HN2    19     1.02003   119.08959     2.93905
   20    18 S   CT1  _CA2    20     1.45956   123.94553   178.73437
   21    20 S   HC   _HA2    21     1.09739   109.50956    -4.63671
   22    20 S   C    _C2_    22     1.53536   108.00292  -119.64993
   23    22 S   O    _O2_    23     1.23046   122.51270  -145.18580
   24    20 S   CT   _CB2    32     1.53207   111.14300   117.77846
   25    24 S   HC   HB21    33     1.09551   110.50403    48.57118
   26    24 S   HC   HB22    34     1.09502   110.58046   166.91316
   27    22 S   N    _N3_    24     1.38470   113.36899    42.86793
   28    27 S   H    _HN3    25     1.01608   119.44323    -5.98550
   29    24 S   S    _SG2    35     1.83182   111.88449   -75.31948
   30    27 S   CT   _CA3    26     1.45259   123.09841   176.89272
   31    30 S   HC   HA31    27     1.09561   107.85774   -55.05210
   32    30 S   HC   HA32    28     1.09556   107.57729    61.30159
   33    29 S   CT   _C13    36     1.82927   100.18121   124.11426
   34    33 S   HC   _H14    37     1.09538   106.11708   151.99694
   35    33 S   HC   _H15    38     1.09269   108.83346    36.30754
   36    30 S   CO3  _C3_    29     1.52939   114.24370  -177.08154
   37    36 S   O2Z  _O31    30     1.26364   116.15825    -2.68227
   38    36 S   O2Z  _O32    31     1.26464   114.39305   177.24019
   39    33 S   CT   _C12    39     1.53279   111.18303   -88.39421
   40    39 S   HC   _H7_    40     1.09272   111.52179    46.23544
   41    39 S   CT   _C11    41     1.54480   113.41313   169.90529
   42    41 S   HC   _H6_    42     1.09783   108.17481   168.54290
   43    39 S   OH   _O35    71     1.43404   108.56224   -71.29304
   44    43 S   HO   _H16    72     0.97357   106.90230    59.22997
   45    41 S   CT   _C10    43     1.54610   113.20678   -70.60540
   46    45 S   HC   _H5_    44     1.09753   108.61757    66.66480
   47    41 S   OH   _O36    69     1.42798   109.00563    52.50030
   48    47 S   HO   _H17    70     0.97369   106.70980    56.29270
   49    45 S   CT   _C6_    45     1.54667   113.04388  -172.64678
   50    49 S   HC   _H3_    46     1.09797   109.30971    53.74417
   51    49 S   CT   _C7_    47     1.53928   110.39043   172.47413
   52    51 S   HC   _H4_    48     1.09719   109.97925    71.82738
   53    49 S   N    _N4_    61     1.46306   111.39955   -65.82208
   54    53 S   H    _H11    62     1.01520   117.66538   -45.24688
   55    51 S   CT   _C8_    49     1.52736   110.98580   -50.25164
   56    55 S   HC   _H12    50     1.09743   109.11150   174.98452
   57    55 S   HC   _H13    51     1.09844   108.23845   -69.61865
   58    51 S   OH   _O40    59     1.42738   109.61247  -170.40286
   59    58 S   HO   _H19    60     0.97230   107.53230   179.05064
   60    53 S   C    _C5_    63     1.38331   123.34392   136.61102
   61    60 S   O    _O33    64     1.22752   125.84613    -1.43436
   62    55 S   CO   _C9_    52     1.52384   111.39111    52.16587
   63    60 S   CT   _C4_    65     1.50472   112.20184   179.46992
   64    63 S   HC   _H8_    66     1.09352   109.55998    68.03578
   65    63 S   HC   _H9_    67     1.09348   109.72198  -172.13903
   66    63 S   HC   _H10    68     1.09377   110.14059   -52.47651
   67    45 S   OS   _O34    53     1.43263   106.87337   -51.21335
   68    62 S   CO3  _C14    54     1.55335   113.42851  -173.86560
   69    68 S   O2Z  _O38    55     1.26785   114.12107  -174.07351
   70    68 S   O2Z  _O37    56     1.26189   116.79810     5.56989
   71    62 S   OH   _O39    57     1.43190   109.20543    66.57970
   72    71 S   HO   _H18    58     0.97411   106.92156   155.79342
  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
  10   5   4   2   1   1  11   6  13   7   3   1  16   7   3   1
  15   8  13   7  10   3  11   6   5   2   1   5   4   6   3   2
   1   1   5   4   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    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    43  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    45    47    43    44  
   35    39    40    41    43  
   39    40    41    43  
   37    38  
   38  
    0  
   40    41    42    45    46    49    67    47    48    43    44  
   41    42    45    47    43    44  
   42    45    46    49    50    51    62    67    53    47    48    43    44  
   45    46    49    67    47    48    43  
   44    45    47  
    0  
   46    49    50    51    52    55    62    67    68    71    58    53    54    60    47    48  
   49    50    51    62    67    53    47  
   48    49    67  
    0  
   50    51    52    55    56    57    62    67    58    59    53    54    60    61    63  
   51    52    55    67    58    53    54    60  
   52    55    56    57    62    67    68    71    58    59    53    54    60  
   55    56    57    62    58    59    53  
   54    60    61    63    64    65    66    55    58    67  
   60    61    63  
   56    57    62    67    68    69    70    71    72    58    59  
   57    62    67    68    71    58  
   62    67    68    71    58  
   59    62  
    0  
   61    63    64    65    66  
   63    64    65    66  
   67    68    69    70    71    72  
   64    65    66  
   65    66  
   66  
    0  
   68    69    70    71    72  
   69    70    71    72  
   70    71  
   71  
   72  
    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   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   44   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   45   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   47   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   48   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   49   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   51   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   54   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   55   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   59   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   60   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   61   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   62   3.5000   0.0660   0.364700   1.9750   1.7500   0.005000000  -0.741685710
   63   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   68   3.7500   0.1050   0.600000   2.1120   1.8750   0.001000000  -0.126889456
   69   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   70   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   71   3.1200   0.1700  -0.582700   1.7660   1.5600   0.021068034  -0.322181743
   72   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
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   268.000  1.529
   39    43   320.000  1.410
   41    42   340.000  1.090
   41    45   268.000  1.529
   41    47   320.000  1.410
   45    46   340.000  1.090
   45    49   268.000  1.529
   45    67   320.000  1.410
   49    50   340.000  1.090
   49    51   268.000  1.529
   49    53   337.000  1.449
   51    52   340.000  1.090
   51    55   268.000  1.529
   51    58   320.000  1.410
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    62   250.000  1.527
   62    67   320.000  1.380
   62    68   205.000  1.564
   62    71   380.000  1.407
   68    69   656.000  1.250
   68    70   656.000  1.250
   71    72   553.000  0.945
   58    59   553.000  0.945
   53    54   434.000  1.010
   53    60   490.000  1.335
   60    61   570.000  1.229
   60    63   317.000  1.522
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   340.000  1.090
   47    48   553.000  0.945
   43    44   553.000  0.945
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    58.35000  112.70000
   33    39    43    50.00000  109.50000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    37.50000  110.70000
   39    41    45    58.35000  112.70000
   39    41    47    50.00000  109.50000
   39    43    44    55.00000  108.50000
   41    39    40    37.50000  110.70000
   41    45    46    37.50000  110.70000
   41    45    49    58.35000  112.70000
   41    45    67    50.00000  109.50000
   41    47    48    55.00000  108.50000
   45    41    42    37.50000  110.70000
   45    49    50    37.50000  110.70000
   45    49    51    58.35000  112.70000
   45    49    53    70.00000  110.72300
   45    67    62    60.00000  109.50000
   49    45    46    37.50000  110.70000
   49    51    52    37.50000  110.70000
   49    51    55    58.35000  112.70000
   49    51    58    50.00000  109.50000
   49    53    54    38.00000  118.40000
   49    53    60    50.00000  121.90000
   51    49    50    37.50000  110.70000
   51    55    56    37.50000  110.70000
   51    55    57    37.50000  110.70000
   51    55    62    75.00000  109.43000
   51    58    59    55.00000  108.50000
   55    51    52    37.50000  110.70000
   55    62    67    90.00000  108.56700
   55    62    68    65.00000  110.28000
   55    62    71    90.00000  110.19100
   57    55    56    33.00000  107.80000
   62    55    56    45.00000  108.72000
   62    55    57    45.00000  108.72000
   62    68    69    85.00000  113.77000
   62    68    70    85.00000  113.77000
   62    71    72    70.00000  107.92000
   67    45    46    35.00000  109.50000
   67    45    49    50.00000  109.50000
   68    62    67    90.00000  109.02000
   70    68    69    80.00000  126.00000
   71    62    67   110.00000  112.08000
   71    62    68    90.00000  109.02000
   58    51    52    35.00000  109.50000
   58    51    55    50.00000  109.50000
   53    49    50    35.00000  109.50000
   53    49    51    70.00000  110.72300
   53    60    61    80.00000  122.90000
   53    60    63    70.00000  116.60000
   60    53    54    35.00000  119.80000
   60    63    64    35.00000  109.50000
   60    63    65    35.00000  109.50000
   60    63    66    35.00000  109.50000
   63    60    61    80.00000  120.40000
   65    63    64    33.00000  107.80000
   66    63    64    33.00000  107.80000
   66    63    65    33.00000  107.80000
   47    41    42    35.00000  109.50000
   47    41    45    50.00000  109.50000
   43    39    40    35.00000  109.50000
   43    39    41    50.00000  109.50000
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   0.44750  1.0 1.0
   29    33    39    41  -0.17800 -1.0 2.0
   29    33    39    41   0.20200  1.0 3.0
   29    33    39    43   0.56750  1.0 1.0
   29    33    39    43  -0.07550 -1.0 2.0
   29    33    39    43   0.20000  1.0 3.0
   33    39    41    42   0.15000  1.0 3.0
   33    39    41    45   0.56750  1.0 1.0
   33    39    41    45  -0.07550 -1.0 2.0
   33    39    41    45   0.20000  1.0 3.0
   33    39    41    47   0.86500  1.0 1.0
   33    39    41    47  -0.17500 -1.0 2.0
   33    39    41    47   0.20800  1.0 3.0
   33    39    43    44  -0.11600  1.0 1.0
   33    39    43    44  -0.09450 -1.0 2.0
   33    39    43    44   0.21250  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    43   0.23400  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41   0.15000  1.0 3.0
   35    33    39    43   0.23400  1.0 3.0
   39    41    45    46   0.15000  1.0 3.0
   39    41    45    49   0.56750  1.0 1.0
   39    41    45    49  -0.07550 -1.0 2.0
   39    41    45    49   0.20000  1.0 3.0
   39    41    45    67   0.62750  1.0 1.0
   39    41    45    67  -0.30950 -1.0 2.0
   39    41    45    67   0.27300  1.0 3.0
   39    41    47    48  -0.11600  1.0 1.0
   39    41    47    48  -0.09450 -1.0 2.0
   39    41    47    48   0.21250  1.0 3.0
   40    39    41    42   0.15000  1.0 3.0
   40    39    41    45   0.15000  1.0 3.0
   40    39    41    47   0.23400  1.0 3.0
   40    39    43    44   0.19450  1.0 3.0
   41    39    43    44  -0.11600  1.0 1.0
   41    39    43    44  -0.09450 -1.0 2.0
   41    39    43    44   0.21250  1.0 3.0
   41    45    49    50   0.15000  1.0 3.0
   41    45    49    51   0.56750  1.0 1.0
   41    45    49    51  -0.07550 -1.0 2.0
   41    45    49    51   0.20000  1.0 3.0
   41    45    49    53   0.43900  1.0 1.0
   41    45    49    53   0.49100 -1.0 2.0
   41    45    49    53   0.28400  1.0 3.0
   41    45    67    62   0.06250  1.0 1.0
   41    45    67    62  -0.01100 -1.0 2.0
   41    45    67    62   0.28050  1.0 3.0
   42    41    45    46   0.15000  1.0 3.0
   42    41    45    49   0.15000  1.0 3.0
   42    41    45    67   0.23400  1.0 3.0
   42    41    47    48   0.19450  1.0 3.0
   45    41    47    48  -0.11600  1.0 1.0
   45    41    47    48  -0.09450 -1.0 2.0
   45    41    47    48   0.21250  1.0 3.0
   45    49    51    52   0.15000  1.0 3.0
   45    49    51    55   0.56750  1.0 1.0
   45    49    51    55  -0.07550 -1.0 2.0
   45    49    51    55   0.20000  1.0 3.0
   45    49    51    58   0.86500  1.0 1.0
   45    49    51    58  -0.17500 -1.0 2.0
   45    49    51    58   0.20800  1.0 3.0
   45    49    53    54   0.00000  1.0 1.0
   45    49    53    60  -0.43950  1.0 1.0
   45    49    53    60  -0.08100 -1.0 2.0
   45    49    53    60   0.03350  1.0 3.0
   46    45    49    50   0.15000  1.0 3.0
   46    45    49    51   0.15000  1.0 3.0
   46    45    49    53   0.15000  1.0 3.0
   46    45    67    62   0.37050  1.0 3.0
   49    45    67    62   0.06250  1.0 1.0
   49    45    67    62  -0.01100 -1.0 2.0
   49    45    67    62   0.28050  1.0 3.0
   49    51    55    56   0.15000  1.0 3.0
   49    51    55    57   0.15000  1.0 3.0
   49    51   -55    62   3.97050  1.0 1.0
   49    51    58    59  -0.11600  1.0 1.0
   49    51    58    59  -0.09450 -1.0 2.0
   49    51    58    59   0.21250  1.0 3.0
   49    53    60    61   3.04450 -1.0 2.0
   49    53    60    63   1.49850  1.0 1.0
   49    53    60    63   1.53950 -1.0 2.0
   50    49    51    52   0.15000  1.0 3.0
   50    49    51    55   0.15000  1.0 3.0
   50    49    51    58   0.23400  1.0 3.0
   50    49    53    54   0.00000  1.0 1.0
   50    49    53    60   0.00000  1.0 1.0
   51    49    53    54   0.00000  1.0 1.0
   51    49    53    60  -0.43950  1.0 1.0
   51    49    53    60  -0.08100 -1.0 2.0
   51    49    53    60   0.03350  1.0 3.0
   51    55    62    67   0.62750  1.0 1.0
   51    55    62    67  -0.30950 -1.0 2.0
   51    55    62    67   0.27300  1.0 3.0
   51    55    62    68  -1.63150  1.0 1.0
   51    55    62    68  -0.43550 -1.0 2.0
   51    55    62    68   0.24500  1.0 3.0
   51    55    62    71   0.86500  1.0 1.0
   51    55    62    71  -0.17500 -1.0 2.0
   51    55    62    71   0.20800  1.0 3.0
   52    51    55    56   0.15000  1.0 3.0
   52    51    55    57   0.15000  1.0 3.0
   52    51    55    62   0.15000  1.0 3.0
   52    51    58    59   0.19450  1.0 3.0
   55    51    58    59  -0.11600  1.0 1.0
   55    51    58    59  -0.09450 -1.0 2.0
   55    51    58    59   0.21250  1.0 3.0
   55    62   -67    45   0.06250  1.0 1.0
   55    62   -67    45  -0.01100 -1.0 2.0
   55    62   -67    45   0.28050  1.0 3.0
   55    62    68    69   0.41150 -1.0 2.0
   55    62    68    70   0.41150 -1.0 2.0
   55    62    71    72  -0.11600  1.0 1.0
   55    62    71    72  -0.09450 -1.0 2.0
   55    62    71    72   0.21250  1.0 3.0
   56    55    62    67   0.23400  1.0 3.0
   56    55    62    68  -0.11250  1.0 3.0
   56    55    62    71   0.23400  1.0 3.0
   57    55    62    67   0.23400  1.0 3.0
   57    55    62    68  -0.11250  1.0 3.0
   57    55    62    71   0.23400  1.0 3.0
   67    45    49    50   0.23400  1.0 3.0
   67    45   -49    51   0.62750  1.0 1.0
   67    45   -49    51  -0.30950 -1.0 2.0
   67    45   -49    51   0.27300  1.0 3.0
   67    45    49    53   1.12100  1.0 1.0
   67    45    49    53  -0.16500 -1.0 2.0
   67    62    68    69   0.30150 -1.0 2.0
   67    62    68    70   0.30150 -1.0 2.0
   67    62    71    72  -0.50000  1.0 1.0
   67    62    71    72  -0.73950 -1.0 2.0
   67    62    71    72   0.17150  1.0 3.0
   68    62    67    45  -1.11000  1.0 1.0
   68    62    67    45   0.50250 -1.0 2.0
   68    62    67    45   0.47450  1.0 3.0
   68    62    71    72   0.91850  1.0 1.0
   68    62    71    72   0.57950  1.0 3.0
   71    62    67    45  -0.81800  1.0 1.0
   71    62    68    69   0.30150 -1.0 2.0
   71    62    68    70   0.30150 -1.0 2.0
   58    51    55    56   0.23400  1.0 3.0
   58    51    55    57   0.23400  1.0 3.0
   58    51    55    62   0.86500  1.0 1.0
   58    51    55    62  -0.17500 -1.0 2.0
   58    51    55    62   0.20800  1.0 3.0
   53    49    51    52   0.15000  1.0 3.0
   53    49    51    55  -0.27100  1.0 1.0
   53    49    51    55  -0.01700 -1.0 2.0
   53    49    51    55  -0.48600  1.0 3.0
   53    49    51    58   2.76900  1.0 1.0
   53    49    51    58  -0.24350 -1.0 2.0
   53    49    51    58  -0.78250  1.0 3.0
   53    60    63    64   0.00000  1.0 1.0
   53    60    63    65   0.00000  1.0 1.0
   53    60    63    66   0.00000  1.0 1.0
   54    53    60    61   2.45000 -1.0 2.0
   54    53    60    63   2.45000 -1.0 2.0
   61    60    63    64   0.00000  1.0 1.0
   61    60    63    65   0.00000  1.0 1.0
   61    60    63    66   0.00000  1.0 1.0
   47    41    45    46   0.23400  1.0 3.0
   47    41    45    49   0.86500  1.0 1.0
   47    41    45    49  -0.17500 -1.0 2.0
   47    41    45    49   0.20800  1.0 3.0
   47    41    45    67   3.69350  1.0 1.0
   47    41    45    67  -1.82950 -1.0 2.0
   43    39    41    42   0.23400  1.0 3.0
   43    39    41    45   0.86500  1.0 1.0
   43    39    41    45  -0.17500 -1.0 2.0
   43    39    41    45   0.20800  1.0 3.0
   43    39    41    47   3.75450  1.0 1.0
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
   37    30    36    38  10.50000 -1.0 2.0
   69    62    68    70  10.50000 -1.0 2.0
   54    60    53    49   1.00000 -1.0 2.0
   53    63    60    61  10.50000 -1.0 2.0
END
