* LIGAND DATABASE FILE (OPLS2005)
*
001      72    73    133    212     398
    1     0 S   NP   _N1_     1    29.55877   100.26871   -19.68466
    2     1 S   H    _HN1     2     1.02769    94.54840  -113.68600
    3     1 S   H    _H1_     3     1.02952    52.26868    -3.90766
    4     1 S   H    _H2_     4     1.02826    63.91828   138.56694
    5     1 S   CT   _CA1     5     1.50148   152.57021    53.70037
    6     5 S   HC   _HA1     6     1.09564   105.24402   132.32175
    7     5 S   CO3  _C1_     7     1.53888   112.13639    11.96761
    8     7 S   O2Z  _O11     8     1.26402   114.94686   -45.36008
    9     7 S   O2Z  _O12     9     1.26199   115.04225   133.47417
   10     5 S   CT   _CB1    10     1.53102   107.39053  -109.54727
   11    10 S   HC   HB11    11     1.09825   109.75256   -47.36009
   12    10 S   HC   HB12    12     1.09808   110.34288    69.37078
   13    10 S   CT   _CG1    13     1.52940   112.40373  -168.19274
   14    13 S   HC   HG11    14     1.09594   110.54127   -60.13994
   15    13 S   HC   HG12    15     1.09638   109.78875    59.03978
   16    13 S   C    _CD1    16     1.51815   112.33748   179.73681
   17    16 S   O    _OE1    17     1.22746   123.31472     3.90470
   18    16 S   N    _N2_    18     1.38498   111.65775  -177.06268
   19    18 S   H    _HN2    19     1.01759   118.69980     6.99207
   20    18 S   CT1  _CA2    20     1.45929   123.06791  -178.41390
   21    20 S   HC   _HA2    21     1.09632   109.97121    16.60113
   22    20 S   C    _C2_    22     1.52546   104.66513  -101.36881
   23    22 S   O    _O2_    23     1.23029   122.39201   -74.82685
   24    20 S   CT   _CB2    32     1.53189   111.46817   139.60713
   25    24 S   HC   HB21    33     1.09412   110.21361    52.26973
   26    24 S   HC   HB22    34     1.09501   110.20429   170.71539
   27    22 S   N    _N3_    24     1.38398   113.10451   101.20041
   28    27 S   H    _HN3    25     1.01666   120.36325     0.22294
   29    24 S   S    _SG2    35     1.82933   110.88822   -69.86842
   30    27 S   CT   _CA3    26     1.45345   122.38317  -178.25684
   31    30 S   HC   HA31    27     1.09575   107.74577   -56.21422
   32    30 S   HC   HA32    28     1.09572   107.63244    60.05922
   33    29 S   CT   _C11    36     1.84910   100.15051   150.07536
   34    33 S   HC   _H5_    37     1.09637   108.81614    18.82220
   35    30 S   CO3  _C3_    29     1.52875   114.46333  -178.26404
   36    35 S   O2Z  _O31    30     1.26321   116.13671    -2.76442
   37    35 S   O2Z  _O32    31     1.26457   114.38135   177.29152
   38    33 S   CM   _C6_    38     1.51895   108.37767   136.62018
   39    38 S   CM   _C7_    39     1.34860   122.85415    91.18488
   40    39 S   CO4  _C8_    40     1.48761   119.71164    -0.74782
   41    40 S   O    _O33    41     1.22284   123.33260  -171.41538
   42    39 S   NE   _N5_    58     1.37396   123.43037   179.29279
   43    42 S   H    _H15    59     1.01714   117.25729   174.87891
   44    40 S   CO4  _C9_    42     1.50854   118.08329     9.85263
   45    44 S   O    _O34    43     1.22174   118.34756  -166.00079
   46    42 S   CT1  _C15    60     1.45335   123.42225     7.76276
   47    46 S   HC   _H7_    61     1.09616   108.80392    85.79363
   48    33 S   CT   _C10    44     1.55081   112.67866  -100.93998
   49    48 S   HC   _H4_    45     1.09781   107.33760   178.97435
   50    46 S   CT   _C4_    62     1.53367   108.91124   -33.92298
   51    50 S   HC   _H8_    63     1.09966   108.91987   -72.18986
   52    50 S   HC   _H9_    64     1.09750   109.75994   172.15240
   53    46 S   CO3  _C16    70     1.54154   107.47611  -158.95522
   54    53 S   O2Z  _O38    71     1.26343   116.39479   129.27794
   55    53 S   O2Z  _O37    72     1.26708   114.88903   -51.70968
   56    48 S   CT   _C12    46     1.54206   113.04467    59.46377
   57    56 S   HC   _H10    47     1.09787   108.35901    46.34275
   58    56 S   HC   _H11    48     1.09556   108.65119   -69.43453
   59    38 S   CT   _C5_    65     1.52463   117.59630   -94.13502
   60    59 S   HC   _H3_    66     1.09959   107.88979   -46.07749
   61    56 S   CT   _C13    49     1.53716   117.49497   168.82689
   62    61 S   HC   _H6_    50     1.09466   110.89850    63.48219
   63    59 S   CO3  _C17    67     1.53660   110.31064    70.95378
   64    63 S   O2Z  _O40    68     1.26211   116.62660    75.80345
   65    63 S   O2Z  _O39    69     1.26632   114.37142  -104.40421
   66    61 S   CO3  _C14    51     1.54917   111.99303  -177.47462
   67    66 S   O2Z  _O36    52     1.26628   113.90199   159.55788
   68    66 S   O2Z  _O35    53     1.26176   116.62026   -20.13806
   69    61 S   NP   _N4_    54     1.49869   109.75919   -52.37672
   70    69 S   H    _H12    55     1.02712   112.59687    70.83143
   71    69 S   H    _H13    56     1.02808   111.72559   -52.01312
   72    69 S   H    _H14    57     1.03048   109.16837  -170.03214
  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   9   5   4   3
  17   7   2   1   1  18  14  10   4  11   4   7   3  10   7   9
   4  10   5   4   3   1   1  11   5   4   4   3   8   7   2   1
   1   6   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    48    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    44    48    49    56    59  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    44    45    48    49    56    57    58    61    42    50    59    60    63  
   38    39    44    48    49    56    59  
   36    37  
   37  
    0  
   39    40    41    44    48    49    56    42    43    46    50    51    52    59    60    63    64    65  
   40    41    44    45    48    42    43    46    47    50    59    60    63    53  
   41    44    45    48    49    56    42    43    46    59  
   44    45    48    42  
   43    46    47    50    51    52    59    53    54    55    44  
   46    47    50    53  
   45    48    49    56    57    58    61  
   48    49    56  
   47    50    51    52    59    60    63    53    54    55  
   50    51    52    59    53    54    55  
   49    56    57    58    61    62    66    69    59  
   56    57    58    61  
   51    52    59    60    63    64    65    53    54    55  
   52    59    60    63    53  
   59    60    63    53  
   54    55    59  
   55  
    0  
   57    58    61    62    66    67    68    69    70    71    72  
   58    61    62    66    69  
   61    62    66    69  
   60    63    64    65  
   63    64    65  
   62    66    67    68    69    70    71    72  
   66    67    68    69    70    71    72  
   64    65  
   65  
    0  
   67    68    69    70    71    72  
   68    69  
   69  
   70    71    72  
   71    72  
   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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0760   0.018000   2.0020   1.7750   0.023028004  -0.852763146
   40   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   42   3.2500   0.1700  -0.494200   1.8650   1.6500   0.051222218  -2.220205820
   43   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   44   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   46   3.5000   0.0660  -0.037500   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   48   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.4200   0.0150   0.060000   1.6450   1.4500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   55   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   56   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.160000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   61   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   63   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   64   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   65   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   66   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
   67   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   68   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   69   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
   70   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
   71   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
   72   0.5000   0.0300   0.210000   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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    48   268.000  1.529
   38    39   549.000  1.340
   38    59   317.000  1.510
   39    40   320.000  1.462
   39    42   425.000  1.378
   40    41   570.000  1.229
   40    44   250.000  1.523
   44    45   570.000  1.229
   44    48   317.000  1.522
   48    49   340.000  1.090
   48    56   268.000  1.529
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    61   268.000  1.529
   61    62   340.000  1.090
   61    66   317.000  1.522
   61    69   367.000  1.471
   66    67   656.000  1.250
   66    68   656.000  1.250
   69    70   434.000  1.010
   69    71   434.000  1.010
   69    72   434.000  1.010
   42    43   434.000  1.010
   42    46   382.000  1.448
   46    47   340.000  1.090
   46    50   268.000  1.529
   46    53   317.000  1.522
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    59   268.000  1.529
   59    60   340.000  1.090
   59    63   317.000  1.522
   63    64   656.000  1.250
   63    65   656.000  1.250
   53    54   656.000  1.250
   53    55   656.000  1.250
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    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    38    75.00000  112.20000
   29    33    48    75.00000  111.63000
   33    38    39    70.00000  124.00000
   33    38    59    65.00000  117.92700
   33    48    44    63.00000  111.10000
   33    48    49    37.50000  110.70000
   33    48    56    58.35000  112.70000
   38    33    34    35.00000  109.50000
   38    39    40    65.00000  118.96000
   38    39    42    70.00000  124.03900
   38    59    50    70.00000  112.02700
   38    59    60    35.00000  109.50000
   38    59    63    65.00000  111.94000
   39    40    41    80.00000  123.72100
   39    40    44    65.00000  116.00000
   39    42    43    35.00000  114.50000
   39    42    46    50.00000  121.00000
   40    44    45    80.00000  119.30300
   40    44    48    65.00000  115.45000
   44    40    41    80.00000  119.30300
   44    48    49    35.00000  109.50000
   44    48    56    63.00000  111.10000
   48    33    34    37.50000  110.70000
   48    33    38    70.00000  112.02700
   48    44    45    80.00000  120.40000
   48    56    57    37.50000  110.70000
   48    56    58    37.50000  110.70000
   48    56    61    58.35000  112.70000
   56    48    49    37.50000  110.70000
   56    61    62    37.50000  110.70000
   56    61    66    70.00000  109.69300
   56    61    69    80.00000  111.20000
   58    56    57    33.00000  107.80000
   61    56    57    37.50000  110.70000
   61    56    58    37.50000  110.70000
   61    66    67    70.00000  117.00000
   61    66    68    70.00000  117.00000
   61    69    70    35.00000  109.50000
   61    69    71    35.00000  109.50000
   61    69    72    35.00000  109.50000
   66    61    62    35.00000  109.50000
   68    66    67    80.00000  126.00000
   69    61    62    35.00000  109.50000
   69    61    66    80.00000  109.26000
   71    69    70    35.00000  109.50000
   72    69    70    35.00000  109.50000
   72    69    71    35.00000  109.50000
   42    39    40    70.00000  117.92000
   42    46    47    35.00000  109.50000
   42    46    50    80.00000  111.61500
   42    46    53    63.00000  110.10000
   46    42    43    35.00000  112.50000
   46    50    51    37.50000  110.70000
   46    50    52    37.50000  110.70000
   46    50    59    58.35000  112.70000
   46    53    54    70.00000  117.00000
   46    53    55    70.00000  117.00000
   50    46    47    37.50000  110.70000
   50    59    60    37.50000  110.70000
   50    59    63    70.00000  109.69300
   52    50    51    33.00000  107.80000
   59    38    39    70.00000  124.00000
   59    50    51    37.50000  110.70000
   59    50    52    37.50000  110.70000
   59    63    64    70.00000  117.00000
   59    63    65    70.00000  117.00000
   63    59    60    35.00000  109.50000
   65    63    64    80.00000  126.00000
   53    46    47    35.00000  109.50000
   53    46    50    63.00000  111.10000
   55    53    54    80.00000  126.00000
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    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    48   0.01700  1.0 1.0
   24    29    33    48  -0.23550 -1.0 2.0
   24    29    33    48   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    38    39   0.42700  1.0 1.0
   29    33    38    39  -0.70350 -1.0 2.0
   29    33    38    39  -0.43150  1.0 3.0
   29    33    38    59   0.30250  1.0 1.0
   29    33    38    59  -0.14950 -1.0 2.0
   29    33    38    59   0.36900  1.0 3.0
   29    33    48    44   0.56750  1.0 1.0
   29    33    48    44  -0.07550 -1.0 2.0
   29    33    48    44   0.20000  1.0 3.0
   29    33    48    49   0.15000  1.0 3.0
   29    33    48    56   0.44750  1.0 1.0
   29    33    48    56  -0.17800 -1.0 2.0
   29    33    48    56   0.20200  1.0 3.0
   33    38    39    40   7.00000 -1.0 2.0
   33    38    39    42   7.00000 -1.0 2.0
   33    38    59    50   0.46850  1.0 1.0
   33    38    59    50   0.08550 -1.0 2.0
   33    38    59    50   0.09800  1.0 3.0
   33    38    59    60   0.34800  1.0 3.0
   33    38    59    63   0.17250  1.0 1.0
   33    38    59    63  -0.04100 -1.0 2.0
   33    38    59    63  -0.33850  1.0 3.0
   33    48    56    57   0.15000  1.0 3.0
   33    48    56    58   0.15000  1.0 3.0
   33    48    56    61   0.56750  1.0 1.0
   33    48    56    61  -0.07550 -1.0 2.0
   33    48    56    61   0.20000  1.0 3.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    59   0.34800  1.0 3.0
   34    33    48    44  -0.11250  1.0 3.0
   34    33    48    49   0.15000  1.0 3.0
   34    33    48    56   0.15000  1.0 3.0
   38    33    48    44  -0.98800  1.0 1.0
   38    33    48    44   0.48800 -1.0 2.0
   38    33    48    44   0.76800  1.0 3.0
   38    33    48    49   0.15000  1.0 3.0
   38    33    48    56   0.34400  1.0 1.0
   38    33    48    56   0.09450 -1.0 2.0
   38    33    48    56   0.11100  1.0 3.0
   38    39    40    41   1.00000 -1.0 2.0
   38    39   -40    44   0.50400  1.0 1.0
   38    39   -40    44   1.60000 -1.0 2.0
   38    39   -40    44  -0.01800  1.0 3.0
   38    39    42    43   1.00000 -1.0 2.0
   38    39    42    46  -0.54700  1.0 1.0
   38    39    42    46   1.23000 -1.0 2.0
   38    59    63    64   0.30150 -1.0 2.0
   38    59    63    65   0.30150 -1.0 2.0
   39    38    59    50   0.09850  1.0 1.0
   39    38    59    50   0.15250 -1.0 2.0
   39    38    59    50  -0.50650  1.0 3.0
   39    38    59    60   0.00000  1.0 1.0
   39    38    59    63  -0.51250  1.0 1.0
   39    38    59    63  -0.88800 -1.0 2.0
   39    38    59    63   0.08850  1.0 3.0
   39    40    44    45   0.03000  1.0 1.0
   39    40    44    45   0.58800 -1.0 2.0
   39    40    44    45   0.15550  1.0 3.0
   39    40    44    48   0.43900  1.0 1.0
   39    40    44    48  -0.18150 -1.0 2.0
   39    40    44    48  -0.03650  1.0 3.0
   39    42    46    47   0.00000  1.0 1.0
   39    42   -46    50   0.25450  1.0 1.0
   39    42   -46    50  -0.61700 -1.0 2.0
   39    42   -46    50  -0.23550  1.0 3.0
   39    42    46    53  -0.12500  1.0 1.0
   39    42    46    53  -0.12500 -1.0 2.0
   39    42    46    53   0.25000  1.0 3.0
   40    39    42    43   1.00000 -1.0 2.0
   40    39    42    46   1.00000 -1.0 2.0
   40    44   -48    33   0.65300  1.0 1.0
   40    44   -48    33  -0.03850 -1.0 2.0
   40    44   -48    33   0.33900  1.0 3.0
   40    44    48    49   0.00000  1.0 1.0
   40    44    48    56   0.65300  1.0 1.0
   40    44    48    56  -0.03850 -1.0 2.0
   40    44    48    56   0.33900  1.0 3.0
   41    40    44    45   0.06100 -1.0 2.0
   41    40    44    48   0.49600 -1.0 2.0
   44    48    56    57  -0.11250  1.0 3.0
   44    48    56    58  -0.11250  1.0 3.0
   44    48    56    61  -0.95700  1.0 1.0
   44    48    56    61  -0.18200 -1.0 2.0
   44    48    56    61   0.29450  1.0 3.0
   45    44    48    33   0.30150 -1.0 2.0
   45    44    48    49   0.00000  1.0 1.0
   45    44    48    56   0.30150 -1.0 2.0
   48    33   -38    39   0.09850  1.0 1.0
   48    33   -38    39   0.15250 -1.0 2.0
   48    33   -38    39  -0.50650  1.0 3.0
   48    33    38    59   0.46850  1.0 1.0
   48    33    38    59   0.08550 -1.0 2.0
   48    33    38    59   0.09800  1.0 3.0
   48    56    61    62   0.15000  1.0 3.0
   48    56    61    66  -1.63150  1.0 1.0
   48    56    61    66  -0.43550 -1.0 2.0
   48    56    61    66   0.24500  1.0 3.0
   48    56    61    69   1.36600  1.0 1.0
   48    56    61    69  -0.11450 -1.0 2.0
   48    56    61    69   0.24250  1.0 3.0
   49    48    56    57   0.15000  1.0 3.0
   49    48    56    58   0.15000  1.0 3.0
   49    48    56    61   0.15000  1.0 3.0
   56    61    66    67   0.41150 -1.0 2.0
   56    61    66    68   0.41150 -1.0 2.0
   56    61    69    70   0.17350  1.0 3.0
   56    61    69    71   0.17350  1.0 3.0
   56    61    69    72   0.17350  1.0 3.0
   57    56    61    62   0.15000  1.0 3.0
   57    56    61    66  -0.11250  1.0 3.0
   57    56    61    69   0.19200  1.0 3.0
   58    56    61    62   0.15000  1.0 3.0
   58    56    61    66  -0.11250  1.0 3.0
   58    56    61    69   0.19200  1.0 3.0
   62    61    66    67   0.00000  1.0 1.0
   62    61    66    68   0.00000  1.0 1.0
   62    61    69    70   0.13050  1.0 3.0
   62    61    69    71   0.13050  1.0 3.0
   62    61    69    72   0.13050  1.0 3.0
   66    61    69    70   0.17350  1.0 3.0
   66    61    69    71   0.17350  1.0 3.0
   66    61    69    72   0.17350  1.0 3.0
   69    61    66    67   0.30150 -1.0 2.0
   69    61    66    68   0.30150 -1.0 2.0
   42    39    40    41  -0.52200  1.0 1.0
   42    39    40    41   0.82950 -1.0 2.0
   42    39    40    44   1.50000 -1.0 2.0
   42    46    50    51   0.22950  1.0 3.0
   42    46    50    52   0.22950  1.0 3.0
   42    46    50    59   1.26750  1.0 1.0
   42    46    50    59  -0.00950 -1.0 2.0
   42    46    50    59   0.30600  1.0 3.0
   42    46    53    54   0.00000  1.0 1.0
   42    46    53    55   0.00000  1.0 1.0
   43    42    46    47   0.00000  1.0 1.0
   43    42    46    50   0.00000  1.0 1.0
   43    42    46    53   0.00000  1.0 1.0
   46    50   -59    38   0.34400  1.0 1.0
   46    50   -59    38   0.09450 -1.0 2.0
   46    50   -59    38   0.11100  1.0 3.0
   46    50    59    60   0.15000  1.0 3.0
   46    50    59    63  -0.84850  1.0 1.0
   46    50    59    63  -0.22800 -1.0 2.0
   46    50    59    63   0.29250  1.0 3.0
   47    46    50    51   0.15000  1.0 3.0
   47    46    50    52   0.15000  1.0 3.0
   47    46    50    59   0.15000  1.0 3.0
   47    46    53    54   0.00000  1.0 1.0
   47    46    53    55   0.00000  1.0 1.0
   50    46    53    54   0.00000  1.0 1.0
   50    46    53    55   0.00000  1.0 1.0
   50    59    63    64   0.41150 -1.0 2.0
   50    59    63    65   0.41150 -1.0 2.0
   51    50    59    38   0.15000  1.0 3.0
   51    50    59    60   0.15000  1.0 3.0
   51    50    59    63  -0.11250  1.0 3.0
   52    50    59    38   0.15000  1.0 3.0
   52    50    59    60   0.15000  1.0 3.0
   52    50    59    63  -0.11250  1.0 3.0
   59    38    39    40   7.00000 -1.0 2.0
   59    38   -39    42   7.00000 -1.0 2.0
   60    59    63    64   0.00000  1.0 1.0
   60    59    63    65   0.00000  1.0 1.0
   53    46    50    51  -0.03800  1.0 3.0
   53    46    50    52  -0.03800  1.0 3.0
   53    46    50    59  -0.84850  1.0 1.0
   53    46    50    59  -0.22800 -1.0 2.0
   53    46    50    59   0.29250  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   33    59    38    39   1.10000 -1.0 2.0
   40    42    39    38   1.10000 -1.0 2.0
   39    44    40    41  10.50000 -1.0 2.0
   40    48    44    45  10.50000 -1.0 2.0
   67    61    66    68  10.50000 -1.0 2.0
   43    39    42    46   1.00000 -1.0 2.0
   64    59    63    65  10.50000 -1.0 2.0
   54    46    53    55  10.50000 -1.0 2.0
END
