* LIGAND DATABASE FILE (OPLS2005)
*
001      69    70    129    200     373
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02067    75.61300   -89.63230
    3     1 S   H    _H1_     3     1.02103   101.34979    16.98741
    4     1 S   H    _H2_     4     1.02103    38.89710   122.81567
    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     1.04724   118.98282     8.58904
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08448   106.40438   -11.12153
   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     1.08733   110.25787    59.12705
   26    24 S   HC   HB22    34     1.08755   109.66015   178.75008
   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   _C10    36     1.82458    98.12763  -158.20644
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CT   _C6_    37     1.55701   110.88083   -40.04824
   38    37 S   HC   _H19    38     1.09604   113.75117    80.70591
   39    37 S   HC   _H20    39     1.09794   110.33663   -40.01388
   40    33 S   S    _S18    60     1.84267   108.71301    79.87375
   41    37 S   C4T  _C9_    40     1.53422   103.74351  -157.83228
   42    41 S   HC   _H23    41     1.09642   113.98066   -87.47991
   43    40 S   CT   _C14    61     1.80437    97.49227    39.00008
   44    43 S   HC   _H31    62     1.09469   108.44930    40.02467
   45    43 S   HC   _H32    63     1.09456   107.59419   -76.57484
   46    41 S   C4T  _C7_    42     1.54706   123.74295   125.81170
   47    46 S   HC   _H21    43     1.09706   113.23634    14.17534
   48    41 S   N4   _N12    46     1.48048   101.41384    31.98358
   49    43 S   CT   _C13    64     1.52261   112.20914   162.87609
   50    49 S   HC   _H29    65     1.09490   109.36651    60.04377
   51    49 S   HC   _H30    66     1.09483   111.94575   -59.26249
   52    46 S   C4   _C4_    44     1.54138    86.03868   -97.79048
   53    52 S   O    _O14    45     1.21044   135.73611   169.67002
   54    33 S   CT1  _C8_    47     1.54479   111.30469  -153.70152
   55    54 S   HC   _H22    48     1.09869   111.78711    33.13746
   56    46 S   CT   _C12    53     1.50909   117.37360   145.92639
   57    56 S   HC   _H27    54     1.09871   110.01181    48.61759
   58    56 S   HC   _H28    55     1.09901   109.95510   166.03235
   59    49 S   NT   _N13    67     1.43799   113.00847   178.53981
   60    59 S   H    _H33    68     1.00692   119.20128   -36.83214
   61    59 S   H    _H34    69     1.00753   119.12826   156.55718
   62    54 S   C    _C5_    49     1.49589   117.91981   -92.78666
   63    62 S   OC3  _O15    50     1.22149   125.07237   -82.21661
   64    56 S   CT   _C11    56     1.50092   112.31958   -72.70133
   65    64 S   HC   _H24    57     1.09659   110.19519   -57.98221
   66    64 S   HC   _H25    58     1.09506   110.54648  -177.38184
   67    64 S   HC   _H26    59     1.09452   110.59745    61.46440
   68    62 S   OH   _O16    51     1.35591   110.67021    97.88501
   69    68 S   HO   _H35    52     0.98023   111.91755   179.93147
  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  11   5   4   3
  18   2   1   1  14   7   6  12  13   6   9   5   4  12   7   8
   5   4   3   8   2   5   3   6   5   4   2   1   1   3   2   3
   2   1   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    54    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    41    48    54    55    62    40    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    41    42    46    52    48    54    55    62    63    68    40    43    44    45    49  
   35    36  
   36  
    0  
   38    39    41    42    46    47    52    48    54    55    62    56    40    43  
   39    41    42    46    48    54    40  
   41    42    46    48    54    40  
   43    44    45    49    50    51    59    41    48    54    55    62  
   42    46    47    52    53    48    54    55    62    56    57    58    64  
   46    47    52    48    54    56  
   44    45    49    50    51    59    60    61    54  
   45    49    50    51    59  
   49    50    51    59  
   47    52    53    48    54    56    57    58    64    65    66    67  
   52    53    48    56    57    58    64  
   54    55    62    63    68    56    52    53  
   50    51    59    60    61  
   51    59    60    61  
   59    60    61  
   53    54    55    62    56    57    58    64  
   54    56  
   55    62    63    68    69  
   62    63    68  
   57    58    64    65    66    67  
   58    64    65    66    67  
   64    65    66    67  
   60    61  
   61  
    0  
   63    68    69  
   68    69  
   65    66    67  
   66    67  
   67  
    0  
   69  
    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   0.335000   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   41   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   43   3.5000   0.0660   0.047500   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   3.5000   0.0660  -0.154800   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.2500   0.1700  -0.445000   1.8100   1.6000   0.054801302  -1.445846770
   49   3.5000   0.0660   0.060000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.7500   0.1050   0.665000   1.9250   1.7000   0.001000000  -0.126889456
   53   2.9600   0.2100  -0.506500   1.5250   1.4250   0.001000000  -1.480495490
   54   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   56   3.5000   0.0660  -0.061200   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.3000   0.1700  -0.900000   1.8650   1.6500   0.051222218  -2.220205820
   60   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   61   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   62   3.7500   0.1050   0.520000   2.1120   1.8750   0.001000000  -0.126889456
   63   2.9600   0.2100  -0.440000   1.9750   1.7500   0.001000000  -0.126889456
   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   3.0000   0.1700  -0.530000   1.7660   1.5600   0.021068034  -0.322181743
   69   0.5000   0.0300   0.450000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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   268.000  1.529
   33    54   268.000  1.529
   33    40   222.000  1.810
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    41   260.000  1.519
   41    42   340.000  1.090
   41    46   268.000  1.529
   41    48   305.000  1.456
   46    47   340.000  1.090
   46    52   250.000  1.540
   46    56   260.000  1.519
   52    53   930.000  1.212
   52    48   440.000  1.369
   48    54   337.000  1.449
   54    55   340.000  1.090
   54    62   317.000  1.522
   62    63   570.000  1.229
   62    68   450.000  1.364
   68    69   553.000  0.945
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    64   268.000  1.529
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   340.000  1.090
   40    43   222.000  1.810
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    49   268.000  1.529
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    59   382.000  1.448
   59    60   434.000  1.010
   59    61   434.000  1.010
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    75.00000  111.63000
   29    33    54    75.00000  108.68000
   29    33    40    75.00000  118.28000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    41    70.00000  112.98000
   33    54    48    80.00000  109.70000
   33    54    55    37.50000  110.70000
   33    54    62    63.00000  111.10000
   33    40    43    62.00000   98.90000
   37    41    42    45.00000  112.72800
   37    41    46    65.00000  119.52000
   37    41    48    80.00000  110.05700
   39    37    38    33.00000  107.80000
   41    37    38    45.00000  111.22300
   41    37    39    45.00000  111.22300
   41    46    47    37.50000  110.70000
   41    46    52   100.00000   86.36000
   41    46    56    65.00000  119.52000
   41    48    52   100.00000   93.00000
   41    48    54    50.00000  132.70000
   46    41    42    37.50000  110.70000
   46    52    53    60.00000  136.58000
   46    52    48    95.00000   92.72400
   46    56    57    45.00000  111.22300
   46    56    58    45.00000  111.22300
   46    56    64    70.00000  112.98000
   52    46    47    40.00000  113.37500
   52    48    54    50.00000  132.10000
   48    41    42    50.00000  112.01000
   48    41    46   105.00000   87.49700
   48    52    53    75.00000  131.60000
   48    54    55    35.00000  109.50000
   48    54    62    63.00000  110.10000
   54    33    37    58.35000  112.70000
   54    62    63    75.00000  119.65400
   54    62    68    80.00000  116.87500
   62    54    55    35.00000  109.50000
   62    68    69    35.00000  113.00000
   68    62    63    80.00000  121.00000
   56    46    47    45.00000  112.72800
   56    46    52    63.00000  111.10000
   56    64    65    37.50000  110.70000
   56    64    66    37.50000  110.70000
   56    64    67    37.50000  110.70000
   58    56    57    33.00000  107.80000
   64    56    57    37.50000  110.70000
   64    56    58    37.50000  110.70000
   66    64    65    33.00000  107.80000
   67    64    65    33.00000  107.80000
   67    64    66    33.00000  107.80000
   40    33    37    75.00000  111.63000
   40    33    54    75.00000  108.68000
   40    43    44    35.00000  109.50000
   40    43    45    35.00000  109.50000
   40    43    49    75.00000  111.63000
   43    49    50    37.50000  110.70000
   43    49    51    37.50000  110.70000
   43    49    59    56.20000  109.47000
   45    43    44    33.00000  107.80000
   49    43    44    37.50000  110.70000
   49    43    45    37.50000  110.70000
   49    59    60    35.00000  109.50000
   49    59    61    35.00000  109.50000
   51    49    50    33.00000  107.80000
   59    49    50    35.00000  109.50000
   59    49    51    35.00000  109.50000
   61    59    60    43.60000  106.40000
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   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    54   0.01700  1.0 1.0
   24    29    33    54  -0.23550 -1.0 2.0
   24    29    33    54   0.21350  1.0 3.0
   24    29    33    40   0.08500  1.0 1.0
   24    29    33    40  -0.53150 -1.0 2.0
   24    29    33    40   0.48050  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    38   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    41   0.44750  1.0 1.0
   29    33    37    41  -0.17800 -1.0 2.0
   29    33    37    41   0.20200  1.0 3.0
   29    33    54    48   0.71400  1.0 1.0
   29    33    54    48   0.04300 -1.0 2.0
   29    33    54    48   0.01450  1.0 3.0
   29    33    54    55   0.15000  1.0 3.0
   29    33    54    62  -2.17200  1.0 1.0
   29    33    54    62  -0.85700 -1.0 2.0
   29    33    40    43   0.08500  1.0 1.0
   29    33    40    43  -0.53150 -1.0 2.0
   29    33    40    43   0.48050  1.0 3.0
   33    37    41    42   0.15000  1.0 3.0
   33    37    41    46   0.04050  1.0 1.0
   33    37    41    46   0.63700 -1.0 2.0
   33    37    41    46   0.17650  1.0 3.0
   33    37   -41    48   0.43900  1.0 1.0
   33    37   -41    48   0.49100 -1.0 2.0
   33    37   -41    48   0.28400  1.0 3.0
   33    54    62    63   0.27300 -1.0 2.0
   33    54    62    68   0.50000  1.0 1.0
   33    54    62    68   0.27300 -1.0 2.0
   33    54    62    68   0.22500  1.0 3.0
   33    40    43    44   0.32350  1.0 3.0
   33    40    43    45   0.32350  1.0 3.0
   33    40    43    49   0.01700  1.0 1.0
   33    40    43    49  -0.23550 -1.0 2.0
   33    40    43    49   0.21350  1.0 3.0
   37    33   -54    48   0.42250  1.0 1.0
   37    33   -54    48  -0.48100 -1.0 2.0
   37    33   -54    48   0.35650  1.0 3.0
   37    33    54    55   0.15000  1.0 3.0
   37    33    54    62  -0.84850  1.0 1.0
   37    33    54    62  -0.22800 -1.0 2.0
   37    33    54    62   0.29250  1.0 3.0
   37    33    40    43   0.01700  1.0 1.0
   37    33    40    43  -0.23550 -1.0 2.0
   37    33    40    43   0.21350  1.0 3.0
   37    41    46    47   0.15000  1.0 3.0
   37    41    46    52  -0.95700  1.0 1.0
   37    41    46    52  -0.18200 -1.0 2.0
   37    41    46    52   0.29450  1.0 3.0
   37    41    46    56   0.56750  1.0 1.0
   37    41    46    56  -0.07550 -1.0 2.0
   37    41    46    56   0.20000  1.0 3.0
   37    41   -48    52   0.00000  1.0 1.0
   37    41   -48    54   0.00000  1.0 1.0
   38    37    41    42   0.15000  1.0 3.0
   38    37    41    46   0.00000  1.0 1.0
   38    37    41    48   0.15000  1.0 3.0
   39    37    41    42   0.15000  1.0 3.0
   39    37    41    46   0.00000  1.0 1.0
   39    37    41    48   0.15000  1.0 3.0
   41    46    52    53  -0.11250  1.0 1.0
   41    46    52    53   0.11400 -1.0 2.0
   41    46    52    53  -0.28950  1.0 3.0
   41    46   -52    48   3.00000 -1.0 2.0
   41    46    56    57   0.00000  1.0 1.0
   41    46    56    58   0.00000  1.0 1.0
   41    46    56    64   0.04050  1.0 1.0
   41    46    56    64   0.63700 -1.0 2.0
   41    46    56    64   0.17650  1.0 3.0
   41    48   -54    33   0.00000  1.0 1.0
   41    48    54    55   0.00000  1.0 1.0
   41    48    54    62   0.00000  1.0 1.0
   42    41    46    47   0.15000  1.0 3.0
   42    41    46    52   0.15000  1.0 3.0
   42    41    46    56   0.15000  1.0 3.0
   42    41   -48    52   0.00000  1.0 1.0
   42    41    48    54   0.00000  1.0 1.0
   46    41   -48    52   0.00000  1.0 1.0
   46    41    48    54   0.00000  1.0 1.0
   46    52   -48    41   3.00000 -1.0 2.0
   46    52   -48    54   3.00000 -1.0 2.0
   46    56    64    65   0.15000  1.0 3.0
   46    56    64    66   0.15000  1.0 3.0
   46    56    64    67   0.15000  1.0 3.0
   47    46    52    53   0.00000  1.0 1.0
   47    46    52    48   0.00000  1.0 1.0
   47    46    56    57   0.15000  1.0 3.0
   47    46    56    58   0.15000  1.0 3.0
   47    46    56    64   0.15000  1.0 3.0
   52    46    56    57  -0.11250  1.0 3.0
   52    46    56    58  -0.11250  1.0 3.0
   52    46    56    64  -0.95700  1.0 1.0
   52    46    56    64  -0.18200 -1.0 2.0
   52    46    56    64   0.29450  1.0 3.0
   52    48    54    33   0.00000  1.0 1.0
   52    48    54    55   0.00000  1.0 1.0
   52    48    54    62   0.00000  1.0 1.0
   53    52   -48    41   3.00000 -1.0 2.0
   53    52    48    54   3.00000 -1.0 2.0
   48    41   -46    47   0.15000  1.0 3.0
   48    41   -46    52   3.00000 -1.0 2.0
   48    41    46    56   0.43900  1.0 1.0
   48    41    46    56   0.49100 -1.0 2.0
   48    41    46    56   0.28400  1.0 3.0
   48    54    62    63   0.00000  1.0 1.0
   48    54    62    68   0.40000  1.0 3.0
   54    33    37    38   0.15000  1.0 3.0
   54    33    37    39   0.15000  1.0 3.0
   54    33   -37    41   0.31550 -1.0 2.0
   54    33   -37    41   0.11250  1.0 3.0
   54    33    40    43   0.01700  1.0 1.0
   54    33    40    43  -0.23550 -1.0 2.0
   54    33    40    43   0.21350  1.0 3.0
   54    62    68    69   1.50000  1.0 1.0
   54    62    68    69   2.45000 -1.0 2.0
   55    54    62    63   0.00000  1.0 1.0
   55    54    62    68   0.00000  1.0 1.0
   63    62    68    69   2.45000 -1.0 2.0
   56    46    52    53   0.30150 -1.0 2.0
   56    46   -52    48   1.39750  1.0 1.0
   56    46   -52    48  -0.07950 -1.0 2.0
   56    46   -52    48  -0.18750  1.0 3.0
   57    56    64    65   0.15000  1.0 3.0
   57    56    64    66   0.15000  1.0 3.0
   57    56    64    67   0.15000  1.0 3.0
   58    56    64    65   0.15000  1.0 3.0
   58    56    64    66   0.15000  1.0 3.0
   58    56    64    67   0.15000  1.0 3.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    41   0.44750  1.0 1.0
   40    33    37    41  -0.17800 -1.0 2.0
   40    33    37    41   0.20200  1.0 3.0
   40    33    54    48   0.71400  1.0 1.0
   40    33    54    48   0.04300 -1.0 2.0
   40    33    54    48   0.01450  1.0 3.0
   40    33    54    55   0.15000  1.0 3.0
   40    33    54    62  -2.17200  1.0 1.0
   40    33    54    62  -0.85700 -1.0 2.0
   40    43    49    50   0.15000  1.0 3.0
   40    43    49    51   0.15000  1.0 3.0
   40    43    49    59   0.56750  1.0 1.0
   40    43    49    59  -0.07550 -1.0 2.0
   40    43    49    59   0.20000  1.0 3.0
   43    49    59    60  -0.05950  1.0 1.0
   43    49    59    60   0.08850 -1.0 2.0
   43    49    59    60   0.11750  1.0 3.0
   43    49    59    61  -0.05950  1.0 1.0
   43    49    59    61   0.08850 -1.0 2.0
   43    49    59    61   0.11750  1.0 3.0
   44    43    49    50   0.15000  1.0 3.0
   44    43    49    51   0.15000  1.0 3.0
   44    43    49    59   0.15000  1.0 3.0
   45    43    49    50   0.15000  1.0 3.0
   45    43    49    51   0.15000  1.0 3.0
   45    43    49    59   0.15000  1.0 3.0
   50    49    59    60   0.20000  1.0 3.0
   50    49    59    61   0.20000  1.0 3.0
   51    49    59    60   0.20000  1.0 3.0
   51    49    59    61   0.20000  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
   46    48    52    53  10.50000 -1.0 2.0
   54    52    48    41   1.00000 -1.0 2.0
   54    68    62    63  10.50000 -1.0 2.0
END
