* LIGAND DATABASE FILE (OPLS2005)
*
001      71    72    131    201     381
    1     0 S   NP   _N1_     1    28.77808    94.05562   -22.95688
    2     1 S   H    _HN1     2     1.02953    87.67692    14.16034
    3     1 S   H    _H1_     3     1.02829    25.22311   154.98829
    4     1 S   H    _H2_     4     1.02779   100.01835   -94.07909
    5     1 S   CT   _CA1     5     1.50120   134.31263   130.75373
    6     5 S   HC   _HA1     6     1.09564   105.23936    70.03716
    7     5 S   CO3  _C1_     7     1.53830   112.37895   -50.30453
    8     7 S   O2Z  _O11     8     1.26380   114.99606   -42.47856
    9     7 S   O2Z  _O12     9     1.26227   114.96141   136.66140
   10     5 S   CT   _CB1    10     1.53071   107.42497  -171.86409
   11    10 S   HC   HB11    11     1.09828   109.55862   -48.61682
   12    10 S   HC   HB12    12     1.09812   110.33216    67.98885
   13    10 S   CT   _CG1    13     1.52992   112.60574  -169.55727
   14    13 S   HC   HG11    14     1.09577   110.59418   -61.89304
   15    13 S   HC   HG12    15     1.09651   109.90749    57.36163
   16    13 S   C    _CD1    16     1.51777   112.21902   177.90875
   17    16 S   O    _OE1    17     1.22736   123.26691     2.31097
   18    16 S   N    _N2_    18     1.38645   111.66035  -178.10555
   19    18 S   H    _HN2    19     1.01586   119.03440     2.40851
   20    18 S   CT1  _CA2    20     1.46247   123.31705  -178.92845
   21    20 S   HC   _HA2    21     1.09737   109.31812    -4.41393
   22    20 S   C    _C2_    22     1.53385   108.70296  -120.06964
   23    22 S   O    _O2_    23     1.23042   122.30079  -148.54161
   24    20 S   CT   _CB2    32     1.53511   111.49173   117.35610
   25    24 S   HC   HB21    33     1.09476   109.46777    58.56867
   26    24 S   HC   HB22    34     1.09437   110.02143   177.49298
   27    22 S   N    _N3_    24     1.38342   113.56731    38.93508
   28    27 S   H    _HN3    25     1.01628   119.49763    -3.64293
   29    24 S   S    _SG2    35     1.82877   110.95504   -62.16486
   30    27 S   CT   _CA3    26     1.45286   123.14744   176.96346
   31    30 S   HC   HA31    27     1.09552   107.52417   -63.88415
   32    30 S   HC   HA32    28     1.09558   107.95015    52.52473
   33    29 S   CT   _C15    36     1.85766   101.52507   179.81025
   34    30 S   CO3  _C3_    29     1.52940   114.13235   174.50588
   35    34 S   O2Z  _O31    30     1.26368   116.06179    -0.87737
   36    34 S   O2Z  _O32    31     1.26430   114.41175   179.18747
   37    33 S   C5BC _C7_    37     1.52420   107.56804    73.39317
   38    33 S   CT   _C12    45     1.54671   111.85038   -52.05100
   39    38 S   HC   _H25    46     1.09475   114.24098    85.06246
   40    38 S   HC   _H26    47     1.09784   111.15280   -35.01114
   41    37 S   C5BC _C4_    38     1.43190   126.80468    63.81608
   42    41 S   HA   _H19    39     1.08111   127.28231    -0.18557
   43    38 S   CT   _C11    48     1.53608   106.44412  -152.12704
   44    43 S   HC   _H23    49     1.09583   109.99312   132.30100
   45    43 S   HC   _H24    50     1.09586   110.82968  -109.38000
   46    41 S   C5A  _C5_    40     1.37352   106.97825   179.95577
   47    46 S   HA   _H20    41     1.08021   133.85129   179.92087
   48    43 S   CT   _C14    51     1.53333   106.37515    10.47970
   49    48 S   HC   _H28    52     1.09942   107.46110   -97.64689
   50    46 S   OA   _O17    42     1.35488   110.38368    -0.05935
   51    33 S   CT   _C13    53     1.56475   111.83612  -164.95940
   52    51 S   HC   _H27    54     1.09721   111.80112   -82.06017
   53    48 S   CT   _C18    68     1.52225   113.71458   144.96375
   54    53 S   HC   _H35    69     1.09392   112.43029   -55.69178
   55    53 S   HC   _H36    70     1.09481   110.65546  -176.88266
   56    53 S   HC   _H37    71     1.09537   110.20556    63.89218
   57    37 S   C5A  _C6_    43     1.38422   128.82566  -116.28011
   58    57 S   HA   _H21    44     1.08057   133.71670     0.02798
   59    51 S   CO4  _C10    55     1.53853   113.88974    40.61642
   60    59 S   O    _O16    56     1.22838   122.90238    67.37825
   61    59 S   CM   _C8_    57     1.49260   116.08996  -113.15466
   62    61 S   HC   _H22    58     1.08633   115.01677   -36.62016
   63    61 S   CM   _C9_    59     1.34516   124.77513   142.19862
   64    63 S   CT   _C16    60     1.50633   119.91566   179.00299
   65    64 S   HC   _H29    61     1.09499   110.30908   118.49823
   66    64 S   HC   _H30    62     1.09519   112.39913    -1.65635
   67    64 S   HC   _H31    63     1.09501   110.18600  -121.66756
   68    63 S   CT   _C17    64     1.50417   126.05443    -2.19250
   69    68 S   HC   _H32    65     1.09459   110.13941   110.77370
   70    68 S   HC   _H33    66     1.09545   109.93781  -129.99411
   71    68 S   HC   _H34    67     1.09181   113.72564   -10.89854
  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  12   5   4   3
  21   2   1   1  15  13   6   5   7   4  11   5   4   4   2  10
   7   2  11   4   4   2   1   1   1   1   6   3  10   3   8   7
   3   2   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    38    51    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    41    57    38    39    40    43    48    51    52    59  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    41    42    46    50    57    58    38    39    40    43    44    45    48    49    51    52    59    60    61    53  
   35    36  
   36  
    0  
   41    42    46    47    50    57    58    38    39    40    43    48    51    52    59  
   39    40    43    44    45    48    49    51    52    59    53    41    57  
   40    43    44    45    48    51  
   43    44    45    48    51  
   42    46    47    50    57    58    51  
   46    47    50    57  
   44    45    48    49    51    52    59    53    54    55    56  
   45    48    49    51    53  
   48    49    51    53  
   47    50    57    58  
   50    57  
   49    51    52    59    60    61    53    54    55    56  
   51    52    59    53    54    55    56  
   57    58  
   52    59    60    61    62    63    53    54    55    56    57  
   59    60    61    53  
   54    55    56    59  
   55    56  
   56  
    0  
   58  
    0  
   60    61    62    63    64    68  
   61    62    63  
   62    63    64    65    66    67    68    69    70    71  
   63    64    68  
   64    65    66    67    68    69    70    71  
   65    66    67    68    69    70    71  
   66    67    68  
   67    68  
   68  
   69    70    71  
   70    71  
   71  
    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   0.282500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.143000   2.0020   1.7750   0.001000000  -0.843144165
   38   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0760  -0.154000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.126000   1.3810   1.2100   0.030040813   0.268726247
   43   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   47   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   48   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.9000   0.1400  -0.190000   1.6450   1.4500   0.001000000  -0.126889456
   51   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   59   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   60   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   61   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   62   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   64   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   285.000  1.502
   33    38   268.000  1.529
   33    51   268.000  1.529
   37    41   469.000  1.424
   37    57   546.000  1.367
   41    42   367.000  1.080
   41    46   546.000  1.367
   46    47   367.000  1.080
   46    50   340.000  1.360
   50    57   340.000  1.360
   57    58   367.000  1.080
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    43   268.000  1.529
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    48   268.000  1.529
   48    49   340.000  1.090
   48    51   268.000  1.529
   48    53   268.000  1.529
   51    52   340.000  1.090
   51    59   317.000  1.522
   59    60   570.000  1.229
   59    61   320.000  1.462
   61    62   340.000  1.080
   61    63   549.000  1.340
   63    64   317.000  1.510
   63    68   317.000  1.510
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   340.000  1.090
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    71   340.000  1.090
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    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    37    80.00000  109.48900
   29    33    38    75.00000  111.63000
   29    33    51    75.00000  111.63000
   33    37    41    60.00000  130.00000
   33    37    57    60.00000  130.00000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    43    58.35000  112.70000
   33    51    48    58.35000  112.70000
   33    51    52    37.50000  110.70000
   33    51    59    63.00000  111.10000
   37    41    42    35.00000  127.50000
   37    41    46    70.00000  107.30000
   37    57    50    70.00000  110.60000
   37    57    58    35.00000  132.10000
   41    46    47    35.00000  132.10000
   41    46    50    70.00000  110.60000
   46    41    42    35.00000  125.70000
   46    50    57    70.00000  106.50000
   50    46    47    35.00000  113.40000
   50    57    58    35.00000  113.40000
   57    37    41    70.00000  107.30000
   38    33    37    70.00000  112.17500
   38    43    44    37.50000  110.70000
   38    43    45    37.50000  110.70000
   38    43    48    58.35000  112.70000
   40    38    39    33.00000  107.80000
   43    38    39    37.50000  110.70000
   43    38    40    37.50000  110.70000
   43    48    49    37.50000  110.70000
   43    48    51    58.35000  112.70000
   43    48    53    58.35000  112.70000
   45    43    44    33.00000  107.80000
   48    43    44    37.50000  110.70000
   48    43    45    37.50000  110.70000
   48    51    52    37.50000  110.70000
   48    51    59    63.00000  111.10000
   48    53    54    37.50000  110.70000
   48    53    55    37.50000  110.70000
   48    53    56    37.50000  110.70000
   51    33    37    70.00000  112.17500
   51    33    38    58.35000  112.70000
   51    48    49    37.50000  110.70000
   51    59    60    80.00000  120.40000
   51    59    61    65.00000  118.62400
   59    51    52    35.00000  109.50000
   59    61    62    40.00000  117.72500
   59    61    63    65.00000  118.96000
   61    59    60    80.00000  123.72100
   61    63    64    70.00000  124.00000
   61    63    68    70.00000  124.00000
   63    61    62    35.00000  120.00000
   63    64    65    35.00000  109.50000
   63    64    66    35.00000  109.50000
   63    64    67    35.00000  109.50000
   63    68    69    35.00000  109.50000
   63    68    70    35.00000  109.50000
   63    68    71    35.00000  109.50000
   66    64    65    33.00000  107.80000
   67    64    65    33.00000  107.80000
   67    64    66    33.00000  107.80000
   68    63    64    65.00000  117.92700
   70    68    69    33.00000  107.80000
   71    68    69    33.00000  107.80000
   71    68    70    33.00000  107.80000
   53    48    49    37.50000  110.70000
   53    48    51    58.35000  112.70000
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37  -0.23050  1.0 1.0
   24    29    33    37   0.06200 -1.0 2.0
   24    29    33    37   0.47200  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    51   0.01700  1.0 1.0
   24    29    33    51  -0.23550 -1.0 2.0
   24    29    33    51   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    37    41  -0.16000  1.0 1.0
   29    33    37    41  -0.03200 -1.0 2.0
   29    33    37    41   0.04500  1.0 3.0
   29    33    37    57  -0.16000  1.0 1.0
   29    33    37    57  -0.03200 -1.0 2.0
   29    33    37    57   0.04500  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    43   0.44750  1.0 1.0
   29    33    38    43  -0.17800 -1.0 2.0
   29    33    38    43   0.20200  1.0 3.0
   29    33    51    48   0.44750  1.0 1.0
   29    33    51    48  -0.17800 -1.0 2.0
   29    33    51    48   0.20200  1.0 3.0
   29    33    51    52   0.15000  1.0 3.0
   29    33    51    59   0.56750  1.0 1.0
   29    33    51    59  -0.07550 -1.0 2.0
   29    33    51    59   0.20000  1.0 3.0
   33    37    41    42   3.62500 -1.0 2.0
   33    37    41    46   3.62500 -1.0 2.0
   33    37    57    50   3.62500 -1.0 2.0
   33    37    57    58   3.62500 -1.0 2.0
   33    38    43    44   0.15000  1.0 3.0
   33    38    43    45   0.15000  1.0 3.0
   33    38   -43    48   0.56750  1.0 1.0
   33    38   -43    48  -0.07550 -1.0 2.0
   33    38   -43    48   0.20000  1.0 3.0
   33    51    59    60   0.30150 -1.0 2.0
   33    51    59    61   0.65300  1.0 1.0
   33    51    59    61  -0.03850 -1.0 2.0
   33    51    59    61   0.33900  1.0 3.0
   37    33    38    39   0.43200  1.0 3.0
   37    33    38    40   0.43200  1.0 3.0
   37    33    38    43  -0.03700  1.0 1.0
   37    33    38    43   0.37200 -1.0 2.0
   37    33    38    43  -0.47300  1.0 3.0
   37    33    51    48  -0.03700  1.0 1.0
   37    33    51    48   0.37200 -1.0 2.0
   37    33    51    48  -0.47300  1.0 3.0
   37    33    51    52   0.43200  1.0 3.0
   37    33    51    59   0.56750  1.0 1.0
   37    33    51    59  -0.07550 -1.0 2.0
   37    33    51    59   0.20000  1.0 3.0
   37    41    46    47   3.62500 -1.0 2.0
   37    41   -46    50   3.62500 -1.0 2.0
   41    37   -57    50   3.62500 -1.0 2.0
   41    37    57    58   3.62500 -1.0 2.0
   41    46   -50    57   3.62500 -1.0 2.0
   42    41    46    47   3.62500 -1.0 2.0
   42    41    46    50   3.62500 -1.0 2.0
   46    50   -57    37   3.62500 -1.0 2.0
   46    50    57    58   3.62500 -1.0 2.0
   47    46    50    57   3.62500 -1.0 2.0
   57    37    41    42   3.62500 -1.0 2.0
   57    37   -41    46   3.62500 -1.0 2.0
   38    33    37    41   0.04150 -1.0 2.0
   38    33    37    57   0.04150 -1.0 2.0
   38    33   -51    48   0.56750  1.0 1.0
   38    33   -51    48  -0.07550 -1.0 2.0
   38    33   -51    48   0.20000  1.0 3.0
   38    33    51    52   0.15000  1.0 3.0
   38    33    51    59  -0.95700  1.0 1.0
   38    33    51    59  -0.18200 -1.0 2.0
   38    33    51    59   0.29450  1.0 3.0
   38    43    48    49   0.15000  1.0 3.0
   38    43   -48    51   0.56750  1.0 1.0
   38    43   -48    51  -0.07550 -1.0 2.0
   38    43   -48    51   0.20000  1.0 3.0
   38    43    48    53   0.56750  1.0 1.0
   38    43    48    53  -0.07550 -1.0 2.0
   38    43    48    53   0.20000  1.0 3.0
   39    38    43    44   0.15000  1.0 3.0
   39    38    43    45   0.15000  1.0 3.0
   39    38    43    48   0.15000  1.0 3.0
   40    38    43    44   0.15000  1.0 3.0
   40    38    43    45   0.15000  1.0 3.0
   40    38    43    48   0.15000  1.0 3.0
   43    48   -51    33   0.56750  1.0 1.0
   43    48   -51    33  -0.07550 -1.0 2.0
   43    48   -51    33   0.20000  1.0 3.0
   43    48    51    52   0.15000  1.0 3.0
   43    48    51    59  -0.95700  1.0 1.0
   43    48    51    59  -0.18200 -1.0 2.0
   43    48    51    59   0.29450  1.0 3.0
   43    48    53    54   0.15000  1.0 3.0
   43    48    53    55   0.15000  1.0 3.0
   43    48    53    56   0.15000  1.0 3.0
   44    43    48    49   0.15000  1.0 3.0
   44    43    48    51   0.15000  1.0 3.0
   44    43    48    53   0.15000  1.0 3.0
   45    43    48    49   0.15000  1.0 3.0
   45    43    48    51   0.15000  1.0 3.0
   45    43    48    53   0.15000  1.0 3.0
   48    51    59    60   0.30150 -1.0 2.0
   48    51    59    61   0.65300  1.0 1.0
   48    51    59    61  -0.03850 -1.0 2.0
   48    51    59    61   0.33900  1.0 3.0
   49    48    51    33   0.15000  1.0 3.0
   49    48    51    52   0.15000  1.0 3.0
   49    48    51    59  -0.11250  1.0 3.0
   49    48    53    54   0.15000  1.0 3.0
   49    48    53    55   0.15000  1.0 3.0
   49    48    53    56   0.15000  1.0 3.0
   51    33    37    41   0.04150 -1.0 2.0
   51    33    37    57   0.04150 -1.0 2.0
   51    33    38    39   0.15000  1.0 3.0
   51    33    38    40   0.15000  1.0 3.0
   51    33   -38    43   0.56750  1.0 1.0
   51    33   -38    43  -0.07550 -1.0 2.0
   51    33   -38    43   0.20000  1.0 3.0
   51    48    53    54   0.15000  1.0 3.0
   51    48    53    55   0.15000  1.0 3.0
   51    48    53    56   0.15000  1.0 3.0
   51    59    61    62   0.04550  1.0 1.0
   51    59    61    62   0.83000 -1.0 2.0
   51    59    61    62  -0.04000  1.0 3.0
   51    59    61    63  -0.33500  1.0 1.0
   51    59    61    63   1.06600 -1.0 2.0
   51    59    61    63  -0.14000  1.0 3.0
   52    51    59    60   0.00000  1.0 1.0
   52    51    59    61   0.00000  1.0 1.0
   59    61    63    64   7.00000 -1.0 2.0
   59    61    63    68   7.00000 -1.0 2.0
   60    59    61    62   0.00000  1.0 1.0
   60    59    61    63   1.00000 -1.0 2.0
   61    63    64    65   0.00000  1.0 1.0
   61    63    64    66   0.00000  1.0 1.0
   61    63    64    67   0.00000  1.0 1.0
   61    63    68    69   0.00000  1.0 1.0
   61    63    68    70   0.00000  1.0 1.0
   61    63    68    71   0.00000  1.0 1.0
   62    61    63    64   7.00000 -1.0 2.0
   62    61    63    68   7.00000 -1.0 2.0
   64    63    68    69   0.34800  1.0 3.0
   64    63    68    70   0.34800  1.0 3.0
   64    63    68    71   0.34800  1.0 3.0
   68    63    64    65   0.34800  1.0 3.0
   68    63    64    66   0.34800  1.0 3.0
   68    63    64    67   0.34800  1.0 3.0
   53    48    51    33   0.56750  1.0 1.0
   53    48    51    33  -0.07550 -1.0 2.0
   53    48    51    33   0.20000  1.0 3.0
   53    48    51    52   0.15000  1.0 3.0
   53    48    51    59  -0.95700  1.0 1.0
   53    48    51    59  -0.18200 -1.0 2.0
   53    48    51    59   0.29450  1.0 3.0
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
   36    30    34    35  10.50000 -1.0 2.0
   41    57    37    33   4.00000 -1.0 2.0
   46    42    41    37   1.10000 -1.0 2.0
   50    47    46    41   1.10000 -1.0 2.0
   50    58    57    37   1.10000 -1.0 2.0
   51    61    59    60  10.50000 -1.0 2.0
   59    62    61    63  15.00000 -1.0 2.0
   64    68    63    61  15.00000 -1.0 2.0
END
