* LIGAND DATABASE FILE (OPLS2005)
*
001      72    74    138    225     416
    1     0 S   NP   _N1_     1    28.80795    94.59897   -20.60026
    2     1 S   H    _HN1     2     1.02777    85.90785   -77.90605
    3     1 S   H    _H1_     3     1.02961    93.01771    30.27072
    4     1 S   H    _H2_     4     1.02837    32.09279   148.16142
    5     1 S   CT   _CA1     5     1.50114   142.40500   160.12850
    6     5 S   HC   _HA1     6     1.09566   105.27197    52.43494
    7     5 S   CO3  _C1_     7     1.53829   112.35167   -67.90810
    8     7 S   O2Z  _O11     8     1.26366   115.00002   -43.50664
    9     7 S   O2Z  _O12     9     1.26234   114.94531   135.72435
   10     5 S   CT   _CB1    10     1.53091   107.44575   170.48260
   11    10 S   HC   HB11    11     1.09819   109.50903   -49.49718
   12    10 S   HC   HB12    12     1.09830   110.33299    67.10835
   13    10 S   CT   _CG1    13     1.53007   112.64114  -170.58316
   14    13 S   HC   HG11    14     1.09571   110.36999   -60.18361
   15    13 S   HC   HG12    15     1.09628   110.13175    59.01120
   16    13 S   C    _CD1    16     1.51794   112.17968   179.34121
   17    16 S   O    _OE1    17     1.22726   123.20351    -9.09295
   18    16 S   N    _N2_    18     1.38601   111.66183   171.15922
   19    18 S   H    _HN2    19     1.01585   119.03371     1.78685
   20    18 S   CT1  _CA2    20     1.46296   123.42214  -176.84086
   21    20 S   HC   _HA2    21     1.09730   109.37412   -14.08206
   22    20 S   C    _C2_    22     1.53373   108.37375  -129.89205
   23    22 S   O    _O2_    23     1.23006   122.29034  -145.85541
   24    20 S   CT   _CB2    32     1.53470   111.12792   107.92052
   25    24 S   HC   HB21    33     1.09575   109.49698    55.57011
   26    24 S   HC   HB22    34     1.09497   110.79648   174.25748
   27    22 S   N    _N3_    24     1.38527   113.32626    41.54523
   28    27 S   H    _HN3    25     1.01530   118.89935    -0.57878
   29    24 S   S    _SG2    35     1.82857   111.44654   -66.09434
   30    27 S   CT   _CA3    26     1.45447   123.42886   175.06894
   31    30 S   HC   HA31    27     1.09524   109.21111    24.91045
   32    30 S   HC   HA32    28     1.09495   107.12952   141.91384
   33    29 S   CT   _C10    36     1.83171    99.73176   148.48808
   34    33 S   HC   _H3_    37     1.09493   110.65103   -40.92110
   35    30 S   CO3  _C3_    29     1.52927   113.12814   -98.54536
   36    35 S   O2Z  _O31    30     1.26401   115.41017   -44.28497
   37    35 S   O2Z  _O32    31     1.26356   114.97757   136.64768
   38    33 S   CM   _C4_    38     1.49230   108.97415    80.76212
   39    38 S   HC   _H21    39     1.08365   123.30855   -46.16860
   40    38 S   CMA  _C5_    40     1.34181   113.74216   135.95752
   41    40 S   OM   _O16    41     1.25908   132.93278   178.19626
   42    40 S   CT   _C16    42     1.55424   109.83577     1.45938
   43    33 S   CT   _C12    43     1.55198   112.25929  -166.09171
   44    43 S   HC   _H28    44     1.10014   107.14783   -29.62134
   45    42 S   CT   _C15    61     1.57377   112.30526  -137.74473
   46    45 S   HC   _H31    62     1.09877   109.44328    24.46964
   47    42 S   CT   _C18    69     1.55778   106.16760    98.77708
   48    47 S   HC   _H35    70     1.09142   112.62600   177.60494
   49    47 S   HC   _H36    71     1.09649   112.12502    57.53914
   50    47 S   HC   _H37    72     1.09681   111.49379   -61.69521
   51    43 S   CT   _C13    45     1.56374   115.08826    89.80536
   52    51 S   HC   _H29    46     1.09515   109.07346    73.69161
   53    45 S   OH   _O19    63     1.43339   109.34635   -91.30704
   54    53 S   HO   _H38    64     0.97494   106.11163    59.83912
   55    51 S   CT   _C9_    47     1.54450   113.96480  -166.11956
   56    55 S   HC   _H24    48     1.09975   109.22007    74.51272
   57    55 S   HC   _H25    49     1.09939   108.55978  -172.44534
   58    51 S   CT   _C17    65     1.53829   113.74092   -43.19087
   59    58 S   HC   _H32    66     1.09469   111.50954   -59.14131
   60    58 S   HC   _H33    67     1.09607   110.59032  -178.63312
   61    58 S   HC   _H34    68     1.09364   111.66719    63.15937
   62    55 S   CT   _C14    50     1.52853   117.75405   -49.71794
   63    62 S   HC   _H30    51     1.09361   111.04871   -61.13584
   64    62 S   CT   _C11    52     1.51845   112.76572    67.38734
   65    64 S   HC   _H27    53     1.09893   109.10171    31.07098
   66    64 S   CM   _C6_    54     1.49531   100.96213   141.89860
   67    66 S   CO4  _C7_    55     1.47519   108.71787   -19.93865
   68    67 S   O    _O17    56     1.21763   127.10952  -171.24979
   69    66 S   CM   _C8_    58     1.33634   129.86036   159.98642
   70    69 S   HC   _H22    59     1.08474   121.03635     0.23821
   71    69 S   HC   _H23    60     1.08508   121.73914  -179.82417
   72    62 S   OS   _O18    57     1.44627   107.18495  -176.68459
  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
  14   7   2   1   1   9   4  13   4  18  19   6  17   7   6   2
   1   1  12   8   5   1  13   6   5   4   2   1   1   8   5   8
   4   6   5   2   3   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    43    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    42    43    44    51  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    44    51    52    55    45    58    47  
   38    39    40    42    43    44    51  
   36    37  
   37  
    0  
   39    40    41    42    43    44    51    45    47  
   40    41    42    43  
   41    42    43    44    51    64    45    46    53    47    48    49    50  
   42    43    45    47  
   43    44    51    52    55    62    64    65    66    45    46    53    54    58    47    48    49    50  
   44    51    52    55    56    57    62    64    45    46    53    58    59    60    61    47    48    49    50  
   51    52    55    45    58    47  
   46    53    54    47    48    49    50    51    55    62    63    64    65    66    67    69    72  
   53    54    47    62    64    65    66  
   48    49    50    51    53    64  
   49    50  
   50  
    0  
   52    55    56    57    62    63    64    72    58    59    60    61  
   55    56    57    62    58    59    60    61  
   54    62    64    65    66  
   64  
   56    57    62    63    64    65    66    67    72    58    59    60    61  
   57    62    63    64    72    58  
   62    63    64    72    58  
   59    60    61    62  
   60    61  
   61  
    0  
   63    64    65    66    67    68    72    69  
   64    65    66    67    72  
   65    66    67    68    72    69    70    71  
   66    67    72    69  
   67    68    72    69    70    71  
   68    72    69    70    71  
   72    69  
   70    71    72  
   71  
    0  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   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  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   43   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   54   0.5000   0.0300   0.418000   0.9960   0.8600   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   64   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   67   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   68   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   69   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   70   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   71   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   72   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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    43   268.000  1.529
   38    39   340.000  1.080
   38    40   465.000  1.376
   40    41   745.000  1.250
   40    42   270.000  1.512
   42    43   268.000  1.529
   42    45   268.000  1.529
   42    47   268.000  1.529
   43    44   340.000  1.090
   43    51   268.000  1.529
   51    52   340.000  1.090
   51    55   268.000  1.529
   51    58   268.000  1.529
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    62   268.000  1.529
   62    63   340.000  1.090
   62    64   268.000  1.529
   62    72   320.000  1.410
   64    65   340.000  1.090
   64    66   317.000  1.510
   64    45   268.000  1.529
   66    67   320.000  1.462
   66    69   549.000  1.340
   67    68   570.000  1.229
   67    72   214.000  1.327
   69    70   340.000  1.080
   69    71   340.000  1.080
   45    46   340.000  1.090
   45    53   320.000  1.410
   53    54   553.000  0.945
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   340.000  1.090
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    50   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    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    43    75.00000  111.63000
   33    38    39    35.00000  117.00000
   33    38    40    70.00000  124.00000
   33    43    42    58.35000  112.70000
   33    43    44    37.50000  110.70000
   33    43    51    58.35000  112.70000
   38    33    34    35.00000  109.50000
   38    40    41    65.00000  137.10300
   38    40    42    65.00000  122.18000
   40    38    39    40.00000  120.50800
   40    42    43    70.00000  112.02700
   40    42    45    70.00000  112.02700
   40    42    47    70.00000  112.02700
   42    40    41    85.00000  112.85300
   42    43    44    37.50000  110.70000
   42    43    51    58.35000  112.70000
   42    45    64    58.35000  112.70000
   42    45    46    37.50000  110.70000
   42    45    53    50.00000  109.50000
   42    47    48    37.50000  110.70000
   42    47    49    37.50000  110.70000
   42    47    50    37.50000  110.70000
   43    33    34    37.50000  110.70000
   43    33    38    70.00000  112.02700
   43    51    52    37.50000  110.70000
   43    51    55    58.35000  112.70000
   43    51    58    58.35000  112.70000
   51    43    44    37.50000  110.70000
   51    55    56    37.50000  110.70000
   51    55    57    37.50000  110.70000
   51    55    62    58.35000  112.70000
   51    58    59    37.50000  110.70000
   51    58    60    37.50000  110.70000
   51    58    61    37.50000  110.70000
   55    51    52    37.50000  110.70000
   55    62    63    37.50000  110.70000
   55    62    64    58.35000  112.70000
   55    62    72    50.00000  109.50000
   57    55    56    33.00000  107.80000
   62    55    56    37.50000  110.70000
   62    55    57    37.50000  110.70000
   62    64    65    37.50000  110.70000
   62    64    66    70.00000  112.02700
   62    64    45    58.35000  112.70000
   62    72    67    83.00000  116.90000
   64    62    63    37.50000  110.70000
   64    66    67    65.00000  116.34900
   64    66    69    70.00000  124.00000
   64    45    46    37.50000  110.70000
   64    45    53    50.00000  109.50000
   66    64    65    35.00000  109.50000
   66    67    68    80.00000  123.72100
   66    67    72    90.00000  111.29400
   66    69    70    35.00000  120.00000
   66    69    71    35.00000  120.00000
   72    62    63    35.00000  109.50000
   72    62    64    50.00000  109.50000
   72    67    68    83.00000  123.40000
   69    66    67    65.00000  118.96000
   71    69    70    35.00000  117.00000
   45    42    43    58.35000  112.70000
   45    64    65    37.50000  110.70000
   45    64    66    70.00000  112.02700
   45    53    54    55.00000  108.50000
   53    45    46    35.00000  109.50000
   58    51    52    37.50000  110.70000
   58    51    55    58.35000  112.70000
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    33.00000  107.80000
   47    42    43    58.35000  112.70000
   47    42    45    58.35000  112.70000
   49    47    48    33.00000  107.80000
   50    47    48    33.00000  107.80000
   50    47    49    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    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    43   0.01700  1.0 1.0
   24    29    33    43  -0.23550 -1.0 2.0
   24    29    33    43   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   0.00000  1.0 1.0
   29    33    38    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    43    42   0.44750  1.0 1.0
   29    33    43    42  -0.17800 -1.0 2.0
   29    33    43    42   0.20200  1.0 3.0
   29    33    43    44   0.15000  1.0 3.0
   29    33    43    51   0.44750  1.0 1.0
   29    33    43    51  -0.17800 -1.0 2.0
   29    33    43    51   0.20200  1.0 3.0
   33    38    40    41   7.00000 -1.0 2.0
   33    38   -40    42   7.00000 -1.0 2.0
   33    43    51    52   0.15000  1.0 3.0
   33    43    51    55   0.56750  1.0 1.0
   33    43    51    55  -0.07550 -1.0 2.0
   33    43    51    55   0.20000  1.0 3.0
   33    43    51    58   0.56750  1.0 1.0
   33    43    51    58  -0.07550 -1.0 2.0
   33    43    51    58   0.20000  1.0 3.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    43    42   0.15000  1.0 3.0
   34    33    43    44   0.15000  1.0 3.0
   34    33    43    51   0.15000  1.0 3.0
   38    33   -43    42   0.34400  1.0 1.0
   38    33   -43    42   0.09450 -1.0 2.0
   38    33   -43    42   0.11100  1.0 3.0
   38    33    43    44   0.15000  1.0 3.0
   38    33    43    51   0.34400  1.0 1.0
   38    33    43    51   0.09450 -1.0 2.0
   38    33    43    51   0.11100  1.0 3.0
   38    40   -42    43   0.09850  1.0 1.0
   38    40   -42    43   0.15250 -1.0 2.0
   38    40   -42    43  -0.50650  1.0 3.0
   38    40    42    45   0.09850  1.0 1.0
   38    40    42    45   0.15250 -1.0 2.0
   38    40    42    45  -0.50650  1.0 3.0
   38    40    42    47   0.09850  1.0 1.0
   38    40    42    47   0.15250 -1.0 2.0
   38    40    42    47  -0.50650  1.0 3.0
   39    38    40    41   7.00000 -1.0 2.0
   39    38    40    42   7.00000 -1.0 2.0
   40    42   -43    33   0.34400  1.0 1.0
   40    42   -43    33   0.09450 -1.0 2.0
   40    42   -43    33   0.11100  1.0 3.0
   40    42    43    44   0.15000  1.0 3.0
   40    42    43    51   0.34400  1.0 1.0
   40    42    43    51   0.09450 -1.0 2.0
   40    42    43    51   0.11100  1.0 3.0
   40    42    45    64   0.34400  1.0 1.0
   40    42    45    64   0.09450 -1.0 2.0
   40    42    45    64   0.11100  1.0 3.0
   40    42    45    46   0.15000  1.0 3.0
   40    42    45    53   1.05650  1.0 1.0
   40    42    45    53   0.15600 -1.0 2.0
   40    42    45    53   0.53150  1.0 3.0
   40    42    47    48   0.15000  1.0 3.0
   40    42    47    49   0.15000  1.0 3.0
   40    42    47    50   0.15000  1.0 3.0
   41    40    42    43   0.09700  1.0 1.0
   41    40    42    43   0.15600 -1.0 2.0
   41    40    42    43  -0.50800  1.0 3.0
   41    40    42    45   0.09700  1.0 1.0
   41    40    42    45   0.15600 -1.0 2.0
   41    40    42    45  -0.50800  1.0 3.0
   41    40    42    47   0.09700  1.0 1.0
   41    40    42    47   0.15600 -1.0 2.0
   41    40    42    47  -0.50800  1.0 3.0
   42    43    51    52   0.15000  1.0 3.0
   42    43    51    55   0.56750  1.0 1.0
   42    43    51    55  -0.07550 -1.0 2.0
   42    43    51    55   0.20000  1.0 3.0
   42    43    51    58   0.56750  1.0 1.0
   42    43    51    58  -0.07550 -1.0 2.0
   42    43    51    58   0.20000  1.0 3.0
   42    45    53    54  -0.11600  1.0 1.0
   42    45    53    54  -0.09450 -1.0 2.0
   42    45    53    54   0.21250  1.0 3.0
   43    33    38    39   0.00000  1.0 1.0
   43    33   -38    40   0.09850  1.0 1.0
   43    33   -38    40   0.15250 -1.0 2.0
   43    33   -38    40  -0.50650  1.0 3.0
   43    42    45    64   0.56750  1.0 1.0
   43    42    45    64  -0.07550 -1.0 2.0
   43    42    45    64   0.20000  1.0 3.0
   43    42    45    46   0.15000  1.0 3.0
   43    42    45    53   0.86500  1.0 1.0
   43    42    45    53  -0.17500 -1.0 2.0
   43    42    45    53   0.20800  1.0 3.0
   43    42    47    48   0.15000  1.0 3.0
   43    42    47    49   0.15000  1.0 3.0
   43    42    47    50   0.15000  1.0 3.0
   43    51    55    56   0.15000  1.0 3.0
   43    51    55    57   0.15000  1.0 3.0
   43    51    55    62   0.56750  1.0 1.0
   43    51    55    62  -0.07550 -1.0 2.0
   43    51    55    62   0.20000  1.0 3.0
   43    51    58    59   0.15000  1.0 3.0
   43    51    58    60   0.15000  1.0 3.0
   43    51    58    61   0.15000  1.0 3.0
   44    43    51    52   0.15000  1.0 3.0
   44    43    51    55   0.15000  1.0 3.0
   44    43    51    58   0.15000  1.0 3.0
   51    55    62    63   0.15000  1.0 3.0
   51    55    62    64   0.56750  1.0 1.0
   51    55    62    64  -0.07550 -1.0 2.0
   51    55    62    64   0.20000  1.0 3.0
   51    55    62    72   0.62750  1.0 1.0
   51    55    62    72  -0.30950 -1.0 2.0
   51    55    62    72   0.27300  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   0.15000  1.0 3.0
   52    51    58    60   0.15000  1.0 3.0
   52    51    58    61   0.15000  1.0 3.0
   55    51    58    59   0.15000  1.0 3.0
   55    51    58    60   0.15000  1.0 3.0
   55    51    58    61   0.15000  1.0 3.0
   55    62    64    65   0.15000  1.0 3.0
   55    62    64    66   0.34400  1.0 1.0
   55    62    64    66   0.09450 -1.0 2.0
   55    62    64    66   0.11100  1.0 3.0
   55    62    64    45   0.56750  1.0 1.0
   55    62    64    45  -0.07550 -1.0 2.0
   55    62    64    45   0.20000  1.0 3.0
   55    62    72    67  -0.25900  1.0 1.0
   55    62    72    67  -0.47000 -1.0 2.0
   55    62    72    67   0.11750  1.0 3.0
   56    55    62    63   0.15000  1.0 3.0
   56    55    62    64   0.15000  1.0 3.0
   56    55    62    72   0.23400  1.0 3.0
   57    55    62    63   0.15000  1.0 3.0
   57    55    62    64   0.15000  1.0 3.0
   57    55    62    72   0.23400  1.0 3.0
   62    64   -66    67   0.09700  1.0 1.0
   62    64   -66    67   0.15600 -1.0 2.0
   62    64   -66    67  -0.50800  1.0 3.0
   62    64    66    69   0.09850  1.0 1.0
   62    64    66    69   0.15250 -1.0 2.0
   62    64    66    69  -0.50650  1.0 3.0
   62    64    45    42   0.56750  1.0 1.0
   62    64    45    42  -0.07550 -1.0 2.0
   62    64    45    42   0.20000  1.0 3.0
   62    64    45    46   0.15000  1.0 3.0
   62    64    45    53   0.86500  1.0 1.0
   62    64    45    53  -0.17500 -1.0 2.0
   62    64    45    53   0.20800  1.0 3.0
   63    62    64    65   0.15000  1.0 3.0
   63    62    64    66   0.15000  1.0 3.0
   63    62    64    45   0.15000  1.0 3.0
   63    62    72    67   0.08050  1.0 3.0
   64    62   -72    67  -0.25900  1.0 1.0
   64    62   -72    67  -0.47000 -1.0 2.0
   64    62   -72    67   0.11750  1.0 3.0
   64    66    67    68  -0.64400  1.0 1.0
   64    66    67    68   0.26850 -1.0 2.0
   64    66   -67    72  -0.15000  1.0 1.0
   64    66   -67    72   0.89550 -1.0 2.0
   64    66   -67    72  -0.06900  1.0 3.0
   64    66    69    70   7.00000 -1.0 2.0
   64    66    69    71   7.00000 -1.0 2.0
   64    45    53    54  -0.11600  1.0 1.0
   64    45    53    54  -0.09450 -1.0 2.0
   64    45    53    54   0.21250  1.0 3.0
   65    64    66    67   0.15000  1.0 3.0
   65    64    66    69   0.00000  1.0 1.0
   65    64    45    42   0.15000  1.0 3.0
   65    64    45    46   0.15000  1.0 3.0
   65    64    45    53   0.23400  1.0 3.0
   66    64    45    42   0.34400  1.0 1.0
   66    64    45    42   0.09450 -1.0 2.0
   66    64    45    42   0.11100  1.0 3.0
   66    64    45    46   0.15000  1.0 3.0
   66    64    45    53   1.05650  1.0 1.0
   66    64    45    53   0.15600 -1.0 2.0
   66    64    45    53   0.53150  1.0 3.0
   66    67   -72    62   2.00000 -1.0 2.0
   67    66    69    70   7.00000 -1.0 2.0
   67    66    69    71   7.00000 -1.0 2.0
   68    67    72    62   3.00000 -1.0 2.0
   72    62    64    65   0.23400  1.0 3.0
   72    62   -64    66   0.61850  1.0 1.0
   72    62   -64    66  -0.22750 -1.0 2.0
   72    62   -64    66   0.15300  1.0 3.0
   72    62    64    45   0.62750  1.0 1.0
   72    62    64    45  -0.30950 -1.0 2.0
   72    62    64    45   0.27300  1.0 3.0
   69    66    67    68   1.00000 -1.0 2.0
   69    66    67    72  -0.56150  1.0 1.0
   69    66    67    72   2.19150 -1.0 2.0
   45    42    43    33   0.56750  1.0 1.0
   45    42    43    33  -0.07550 -1.0 2.0
   45    42    43    33   0.20000  1.0 3.0
   45    42    43    44   0.15000  1.0 3.0
   45    42    43    51   0.56750  1.0 1.0
   45    42    43    51  -0.07550 -1.0 2.0
   45    42    43    51   0.20000  1.0 3.0
   45    42    47    48   0.15000  1.0 3.0
   45    42    47    49   0.15000  1.0 3.0
   45    42    47    50   0.15000  1.0 3.0
   45    64    66    67   0.09700  1.0 1.0
   45    64    66    67   0.15600 -1.0 2.0
   45    64    66    67  -0.50800  1.0 3.0
   45    64    66    69   0.09850  1.0 1.0
   45    64    66    69   0.15250 -1.0 2.0
   45    64    66    69  -0.50650  1.0 3.0
   46    45    53    54   0.19450  1.0 3.0
   58    51    55    56   0.15000  1.0 3.0
   58    51    55    57   0.15000  1.0 3.0
   58    51    55    62   0.56750  1.0 1.0
   58    51    55    62  -0.07550 -1.0 2.0
   58    51    55    62   0.20000  1.0 3.0
   47    42    43    33   0.56750  1.0 1.0
   47    42    43    33  -0.07550 -1.0 2.0
   47    42    43    33   0.20000  1.0 3.0
   47    42    43    44   0.15000  1.0 3.0
   47    42    43    51   0.56750  1.0 1.0
   47    42    43    51  -0.07550 -1.0 2.0
   47    42    43    51   0.20000  1.0 3.0
   47    42    45    64   0.56750  1.0 1.0
   47    42    45    64  -0.07550 -1.0 2.0
   47    42    45    64   0.20000  1.0 3.0
   47    42    45    46   0.15000  1.0 3.0
   47    42    45    53   0.86500  1.0 1.0
   47    42    45    53  -0.17500 -1.0 2.0
   47    42    45    53   0.20800  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
   37    30    35    36  10.50000 -1.0 2.0
   33    39    38    40   1.10000 -1.0 2.0
   42    41    40    38   1.10000 -1.0 2.0
   64    67    66    69   1.10000 -1.0 2.0
   66    72    67    68  10.50000 -1.0 2.0
   70    71    69    66   1.10000 -1.0 2.0
END
