* LIGAND DATABASE FILE (OPLS2005)
*
001      74    75    142    225     427
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02046    96.70975   -56.88374
    3     1 S   H    _H1_     3     1.02080    82.85815    51.20334
    4     1 S   H    _H2_     4     1.02128    34.65838  -170.20726
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04748   118.84952     8.59078
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08457   106.27517   -11.11459
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    33     1.08610   110.54789    58.81774
   26    24 S   HC   HB22    34     1.08612   109.94660   179.13182
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C12    36     1.83380    97.76228  -178.14523
   34    33 S   HC   _H3_    37     1.10698   105.20210    41.85190
   35    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   36    35 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   37    35 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   38    33 S   CM   _C4_    38     1.51653   109.89346   159.97230
   39    33 S   CT   _C10    54     1.54093   111.71508   -73.64443
   40    39 S   HC   _H27    55     1.09561   109.12142    44.55268
   41    39 S   HC   _H28    56     1.09620   107.98623   158.40242
   42    38 S   CT   _C11    39     1.52392   115.53361    81.59097
   43    42 S   HC   _H29    40     1.09865   106.94764   -65.11659
   44    38 S   CMA  _C5_    72     1.34535   119.64198  -100.64017
   45    44 S   OM   _O16    73     1.25644   132.01400  -177.56860
   46    44 S   HC   _H19    74     1.09150   111.62774     2.45104
   47    42 S   CT   _C14    41     1.57138   111.76322    53.09771
   48    42 S   CO4  _C6_    69     1.50947   112.45186  -178.21535
   49    48 S   O    _O17    70     1.22675   123.41525    85.13585
   50    48 S   HC   _H20    71     1.10237   115.61753   -94.79482
   51    47 S   CT   _C8_    42     1.55053   109.56113  -176.77845
   52    51 S   HC   _H23    43     1.09781   109.46845    47.27234
   53    51 S   HC   _H24    44     1.09670   110.50590   -69.44909
   54    47 S   CT   _C16    65     1.55055   109.50105    63.91624
   55    54 S   HC   _H32    66     1.08188   108.63851   -60.27809
   56    54 S   HC   _H33    67     1.08101   108.65430   179.77883
   57    54 S   HC   _H34    68     1.08117   108.68417    59.71411
   58    51 S   CT   _C7_    45     1.52540   113.44053   168.38763
   59    58 S   HC   _H21    46     1.09474   110.85121    65.94956
   60    58 S   HC   _H22    47     1.09717   108.85981  -177.74458
   61    58 S   CT   _C9_    48     1.52326   111.52860   -57.57767
   62    61 S   HC   _H25    49     1.09767   109.01557   179.86730
   63    61 S   HC   _H26    50     1.09876   107.83866   -65.49804
   64    61 S   CT   _C15    51     1.54917   114.16214    56.12614
   65    47 S   CT   _C13    52     1.57800   106.41833   -59.28796
   66    65 S   HC   _H31    53     1.10227   104.60015   -53.13361
   67    64 S   CT   _C17    57     1.54102   110.01025    77.25724
   68    67 S   HC   _H35    58     1.08459   109.15781  -179.97202
   69    67 S   HC   _H36    59     1.08446   109.15360    60.00884
   70    67 S   HC   _H37    60     1.08394   109.16164   -59.96501
   71    64 S   CT   _C18    61     1.55252   106.66747  -168.14329
   72    71 S   HC   _H38    62     1.08040   108.57663  -179.96044
   73    71 S   HC   _H39    63     1.08024   108.53753    59.98481
   74    71 S   HC   _H40    64     1.08093   108.57806   -59.96956
  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
  15   7   2   1   1  15  13   5   4  19   8   4   1   1  19   5
   1   1  15   7   6   7   3   2   1   9   5   4  13   5   4  10
   9   2   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    42    65    39    40    41    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    42    43    47    64    65    66    39    40    41    48    44    45    46  
   38    42    65    39    40    41    44  
   36    37  
   37  
    0  
   42    43    47    51    65    39    40    41    54    48    49    50    44    45    46  
   40    41    67    71    54    44    42    47    51    61    64    65    66  
   41    47    64    65    66  
   47    64    65    66  
   43    47    51    52    53    58    64    65    66    54    55    56    57    48    49    50    44    45    46  
   47    51    65    54    48    49    50    44  
   45    46    47    48  
   46  
    0  
   51    52    53    58    59    60    61    64    65    66    67    71    54    55    56    57    48    49    50  
   49    50    51    54    65  
   50  
    0  
   52    53    58    59    60    61    62    63    64    65    66    54    55    56    57  
   53    58    59    60    61    65    54  
   58    59    60    61    65    54  
   55    56    57    58    64    65    66  
   56    57    65  
   57    65  
   65  
   59    60    61    62    63    64    65    67    71  
   60    61    62    63    64  
   61    62    63    64  
   62    63    64    65    66    67    68    69    70    71    72    73    74  
   63    64    65    67    71  
   64    65    67    71  
   65    66    67    68    69    70    71    72    73    74  
   66    67    68    69    70    71    72    73    74  
   67    71  
   68    69    70    71    72    73    74  
   69    70    71  
   70    71  
   71  
   72    73    74  
   73    74  
   74  
    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  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   44   3.5500   0.0760   0.437200   2.0020   1.7750   0.023028004  -0.852763146
   45   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   46   2.5000   0.0500  -0.062100   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   48   3.7500   0.1050   0.450000   2.1120   1.8750   0.001000000  -0.126889456
   49   2.9600   0.2100  -0.450000   1.6780   1.4800   0.001000000  -0.126889456
   50   2.4200   0.0150   0.000000   1.3810   1.2100   0.008598240   0.268726247
   51   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.120000   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   65   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   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    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    39   268.000  1.529
   38    42   317.000  1.510
   38    44   465.000  1.376
   42    43   340.000  1.090
   42    47   268.000  1.529
   42    48   317.000  1.522
   47    51   268.000  1.529
   47    65   268.000  1.529
   47    54   268.000  1.529
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    58   268.000  1.529
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   268.000  1.529
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   268.000  1.529
   64    65   268.000  1.529
   64    67   268.000  1.529
   64    71   268.000  1.529
   65    66   340.000  1.090
   65    39   268.000  1.529
   39    40   340.000  1.090
   39    41   340.000  1.090
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   340.000  1.090
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   340.000  1.090
   48    49   570.000  1.229
   48    50   340.000  1.090
   44    45   745.000  1.250
   44    46   335.000  1.111
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    39    75.00000  111.63000
   33    38    42    65.00000  117.92700
   33    38    44    70.00000  124.00000
   33    39    65    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   38    33    34    35.00000  109.50000
   38    42    43    35.00000  109.50000
   38    42    47    70.00000  112.02700
   38    42    48    70.00000  109.06800
   38    44    45    65.00000  137.10300
   38    44    46    45.00000  105.30000
   42    47    51    58.35000  112.70000
   42    47    65    58.35000  112.70000
   42    47    54    58.35000  112.70000
   42    48    49    80.00000  120.40000
   42    48    50    35.00000  115.00000
   47    42    43    37.50000  110.70000
   47    51    52    37.50000  110.70000
   47    51    53    37.50000  110.70000
   47    51    58    58.35000  112.70000
   47    65    64    58.35000  112.70000
   47    65    66    37.50000  110.70000
   47    65    39    58.35000  112.70000
   47    54    55    37.50000  110.70000
   47    54    56    37.50000  110.70000
   47    54    57    37.50000  110.70000
   51    58    59    37.50000  110.70000
   51    58    60    37.50000  110.70000
   51    58    61    58.35000  112.70000
   53    51    52    33.00000  107.80000
   58    51    52    37.50000  110.70000
   58    51    53    37.50000  110.70000
   58    61    62    37.50000  110.70000
   58    61    63    37.50000  110.70000
   58    61    64    58.35000  112.70000
   60    58    59    33.00000  107.80000
   61    58    59    37.50000  110.70000
   61    58    60    37.50000  110.70000
   61    64    65    58.35000  112.70000
   61    64    67    58.35000  112.70000
   61    64    71    58.35000  112.70000
   63    61    62    33.00000  107.80000
   64    61    62    37.50000  110.70000
   64    61    63    37.50000  110.70000
   64    65    66    37.50000  110.70000
   64    65    39    58.35000  112.70000
   64    67    68    37.50000  110.70000
   64    67    69    37.50000  110.70000
   64    67    70    37.50000  110.70000
   64    71    72    37.50000  110.70000
   64    71    73    37.50000  110.70000
   64    71    74    37.50000  110.70000
   65    47    51    58.35000  112.70000
   65    39    40    37.50000  110.70000
   65    39    41    37.50000  110.70000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.02700
   39    65    66    37.50000  110.70000
   41    39    40    33.00000  107.80000
   67    64    65    58.35000  112.70000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   71    64    65    58.35000  112.70000
   71    64    67    58.35000  112.70000
   73    71    72    33.00000  107.80000
   74    71    72    33.00000  107.80000
   74    71    73    33.00000  107.80000
   54    47    51    58.35000  112.70000
   54    47    65    58.35000  112.70000
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    33.00000  107.80000
   48    42    43    35.00000  109.50000
   48    42    47    63.00000  111.10000
   50    48    49    35.00000  123.00000
   44    38    42    70.00000  124.00000
   46    44    45    50.00000  124.16400
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    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    42   0.30250  1.0 1.0
   29    33    38    42  -0.14950 -1.0 2.0
   29    33    38    42   0.36900  1.0 3.0
   29    33    38    44   0.42700  1.0 1.0
   29    33    38    44  -0.70350 -1.0 2.0
   29    33    38    44  -0.43150  1.0 3.0
   29    33    39    65   0.44750  1.0 1.0
   29    33    39    65  -0.17800 -1.0 2.0
   29    33    39    65   0.20200  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   33    38    42    43   0.34800  1.0 3.0
   33    38    42    47   0.46850  1.0 1.0
   33    38    42    47   0.08550 -1.0 2.0
   33    38    42    47   0.09800  1.0 3.0
   33    38    42    48   0.17250  1.0 1.0
   33    38    42    48  -0.04100 -1.0 2.0
   33    38    42    48  -0.33850  1.0 3.0
   33    38    44    45   7.00000 -1.0 2.0
   33    38    44    46   7.00000 -1.0 2.0
   34    33    38    42   0.34800  1.0 3.0
   34    33    38    44   0.00000  1.0 1.0
   34    33    39    65   0.15000  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   38    33    39    65   0.34400  1.0 1.0
   38    33    39    65   0.09450 -1.0 2.0
   38    33    39    65   0.11100  1.0 3.0
   38    33    39    40   0.15000  1.0 3.0
   38    33    39    41   0.15000  1.0 3.0
   38    42    47    51   0.34400  1.0 1.0
   38    42    47    51   0.09450 -1.0 2.0
   38    42    47    51   0.11100  1.0 3.0
   38    42   -47    65   0.34400  1.0 1.0
   38    42   -47    65   0.09450 -1.0 2.0
   38    42   -47    65   0.11100  1.0 3.0
   38    42    47    54   0.34400  1.0 1.0
   38    42    47    54   0.09450 -1.0 2.0
   38    42    47    54   0.11100  1.0 3.0
   38    42    48    49   0.30150 -1.0 2.0
   38    42    48    50   0.81450  1.0 1.0
   38    42    48    50  -0.29600 -1.0 2.0
   38    42    48    50   0.60450  1.0 3.0
   42    38    44    45   7.00000 -1.0 2.0
   42    38    44    46   7.00000 -1.0 2.0
   42    47    51    52   0.15000  1.0 3.0
   42    47    51    53   0.15000  1.0 3.0
   42    47    51    58   0.56750  1.0 1.0
   42    47    51    58  -0.07550 -1.0 2.0
   42    47    51    58   0.20000  1.0 3.0
   42    47    65    64   0.56750  1.0 1.0
   42    47    65    64  -0.07550 -1.0 2.0
   42    47    65    64   0.20000  1.0 3.0
   42    47    65    66   0.15000  1.0 3.0
   42    47    65    39   0.56750  1.0 1.0
   42    47    65    39  -0.07550 -1.0 2.0
   42    47    65    39   0.20000  1.0 3.0
   42    47    54    55   0.15000  1.0 3.0
   42    47    54    56   0.15000  1.0 3.0
   42    47    54    57   0.15000  1.0 3.0
   43    42    47    51   0.15000  1.0 3.0
   43    42    47    65   0.15000  1.0 3.0
   43    42    47    54   0.15000  1.0 3.0
   43    42    48    49   0.00000  1.0 1.0
   43    42    48    50   0.00000  1.0 1.0
   47    42    48    49   0.30150 -1.0 2.0
   47    42    48    50   0.74550  1.0 1.0
   47    42    48    50  -0.00500 -1.0 2.0
   47    51    58    59   0.15000  1.0 3.0
   47    51    58    60   0.15000  1.0 3.0
   47    51    58    61   0.56750  1.0 1.0
   47    51    58    61  -0.07550 -1.0 2.0
   47    51    58    61   0.20000  1.0 3.0
   47    65   -39    33   0.56750  1.0 1.0
   47    65   -39    33  -0.07550 -1.0 2.0
   47    65   -39    33   0.20000  1.0 3.0
   47    65    39    40   0.15000  1.0 3.0
   47    65    39    41   0.15000  1.0 3.0
   51    47    65    64   0.56750  1.0 1.0
   51    47    65    64  -0.07550 -1.0 2.0
   51    47    65    64   0.20000  1.0 3.0
   51    47    65    66   0.15000  1.0 3.0
   51    47    65    39   0.56750  1.0 1.0
   51    47    65    39  -0.07550 -1.0 2.0
   51    47    65    39   0.20000  1.0 3.0
   51    47    54    55   0.15000  1.0 3.0
   51    47    54    56   0.15000  1.0 3.0
   51    47    54    57   0.15000  1.0 3.0
   51    58    61    62   0.15000  1.0 3.0
   51    58    61    63   0.15000  1.0 3.0
   51    58   -61    64   0.56750  1.0 1.0
   51    58   -61    64  -0.07550 -1.0 2.0
   51    58   -61    64   0.20000  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
   53    51    58    59   0.15000  1.0 3.0
   53    51    58    60   0.15000  1.0 3.0
   53    51    58    61   0.15000  1.0 3.0
   58    61    64    65   0.56750  1.0 1.0
   58    61    64    65  -0.07550 -1.0 2.0
   58    61    64    65   0.20000  1.0 3.0
   58    61    64    67   0.56750  1.0 1.0
   58    61    64    67  -0.07550 -1.0 2.0
   58    61    64    67   0.20000  1.0 3.0
   58    61    64    71   0.56750  1.0 1.0
   58    61    64    71  -0.07550 -1.0 2.0
   58    61    64    71   0.20000  1.0 3.0
   59    58    61    62   0.15000  1.0 3.0
   59    58    61    63   0.15000  1.0 3.0
   59    58    61    64   0.15000  1.0 3.0
   60    58    61    62   0.15000  1.0 3.0
   60    58    61    63   0.15000  1.0 3.0
   60    58    61    64   0.15000  1.0 3.0
   61    64   -65    47   0.56750  1.0 1.0
   61    64   -65    47  -0.07550 -1.0 2.0
   61    64   -65    47   0.20000  1.0 3.0
   61    64    65    66   0.15000  1.0 3.0
   61    64    65    39   0.56750  1.0 1.0
   61    64    65    39  -0.07550 -1.0 2.0
   61    64    65    39   0.20000  1.0 3.0
   61    64    67    68   0.15000  1.0 3.0
   61    64    67    69   0.15000  1.0 3.0
   61    64    67    70   0.15000  1.0 3.0
   61    64    71    72   0.15000  1.0 3.0
   61    64    71    73   0.15000  1.0 3.0
   61    64    71    74   0.15000  1.0 3.0
   62    61    64    65   0.15000  1.0 3.0
   62    61    64    67   0.15000  1.0 3.0
   62    61    64    71   0.15000  1.0 3.0
   63    61    64    65   0.15000  1.0 3.0
   63    61    64    67   0.15000  1.0 3.0
   63    61    64    71   0.15000  1.0 3.0
   64    65    39    33   0.56750  1.0 1.0
   64    65    39    33  -0.07550 -1.0 2.0
   64    65    39    33   0.20000  1.0 3.0
   64    65    39    40   0.15000  1.0 3.0
   64    65    39    41   0.15000  1.0 3.0
   65    47    51    52   0.15000  1.0 3.0
   65    47    51    53   0.15000  1.0 3.0
   65    47   -51    58   0.56750  1.0 1.0
   65    47   -51    58  -0.07550 -1.0 2.0
   65    47   -51    58   0.20000  1.0 3.0
   65    47    54    55   0.15000  1.0 3.0
   65    47    54    56   0.15000  1.0 3.0
   65    47    54    57   0.15000  1.0 3.0
   65    64    67    68   0.15000  1.0 3.0
   65    64    67    69   0.15000  1.0 3.0
   65    64    67    70   0.15000  1.0 3.0
   65    64    71    72   0.15000  1.0 3.0
   65    64    71    73   0.15000  1.0 3.0
   65    64    71    74   0.15000  1.0 3.0
   66    65    39    33   0.15000  1.0 3.0
   66    65    39    40   0.15000  1.0 3.0
   66    65    39    41   0.15000  1.0 3.0
   39    33   -38    42   0.46850  1.0 1.0
   39    33   -38    42   0.08550 -1.0 2.0
   39    33   -38    42   0.09800  1.0 3.0
   39    33    38    44   0.09850  1.0 1.0
   39    33    38    44   0.15250 -1.0 2.0
   39    33    38    44  -0.50650  1.0 3.0
   67    64    65    47   0.56750  1.0 1.0
   67    64    65    47  -0.07550 -1.0 2.0
   67    64    65    47   0.20000  1.0 3.0
   67    64    65    66   0.15000  1.0 3.0
   67    64    65    39   0.56750  1.0 1.0
   67    64    65    39  -0.07550 -1.0 2.0
   67    64    65    39   0.20000  1.0 3.0
   67    64    71    72   0.15000  1.0 3.0
   67    64    71    73   0.15000  1.0 3.0
   67    64    71    74   0.15000  1.0 3.0
   71    64    65    47   0.56750  1.0 1.0
   71    64    65    47  -0.07550 -1.0 2.0
   71    64    65    47   0.20000  1.0 3.0
   71    64    65    66   0.15000  1.0 3.0
   71    64    65    39   0.56750  1.0 1.0
   71    64    65    39  -0.07550 -1.0 2.0
   71    64    65    39   0.20000  1.0 3.0
   71    64    67    68   0.15000  1.0 3.0
   71    64    67    69   0.15000  1.0 3.0
   71    64    67    70   0.15000  1.0 3.0
   54    47    51    52   0.15000  1.0 3.0
   54    47    51    53   0.15000  1.0 3.0
   54    47    51    58   0.56750  1.0 1.0
   54    47    51    58  -0.07550 -1.0 2.0
   54    47    51    58   0.20000  1.0 3.0
   54    47    65    64   0.56750  1.0 1.0
   54    47    65    64  -0.07550 -1.0 2.0
   54    47    65    64   0.20000  1.0 3.0
   54    47    65    66   0.15000  1.0 3.0
   54    47    65    39   0.56750  1.0 1.0
   54    47    65    39  -0.07550 -1.0 2.0
   54    47    65    39   0.20000  1.0 3.0
   48    42    47    51  -0.95700  1.0 1.0
   48    42    47    51  -0.18200 -1.0 2.0
   48    42    47    51   0.29450  1.0 3.0
   48    42    47    65  -0.95700  1.0 1.0
   48    42    47    65  -0.18200 -1.0 2.0
   48    42    47    65   0.29450  1.0 3.0
   48    42    47    54  -0.95700  1.0 1.0
   48    42    47    54  -0.18200 -1.0 2.0
   48    42    47    54   0.29450  1.0 3.0
   44    38    42    43   0.00000  1.0 1.0
   44    38    42    47   0.09850  1.0 1.0
   44    38    42    47   0.15250 -1.0 2.0
   44    38    42    47  -0.50650  1.0 3.0
   44    38    42    48  -0.51250  1.0 1.0
   44    38    42    48  -0.88800 -1.0 2.0
   44    38    42    48   0.08850  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    42    38    44   1.10000 -1.0 2.0
   42    50    48    49  10.50000 -1.0 2.0
   45    46    44    38   1.10000 -1.0 2.0
END
