* LIGAND DATABASE FILE (OPLS2005)
*
001      74    76    145    234     437
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02120    40.05228   119.18605
    3     1 S   H    _H1_     3     1.02102    74.05483   -91.74474
    4     1 S   H    _H2_     4     1.02078   102.12687    14.46947
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    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     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08610   110.54789    58.78698
   26    24 S   HC   HB22    34     1.08612   109.94660   179.10082
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C17    36     1.84170    97.66839   161.82258
   34    33 S   HC   _H6_    37     1.10984   105.78712    37.87970
   35    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   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   CT   _C16    38     1.53602   108.93074   -79.95841
   39    38 S   HC   _H23    39     1.09895   110.63123   159.59337
   40    38 S   HC   _H24    40     1.09896   112.10915    38.79817
   41    38 S   CO4  _C15    41     1.51065   111.34683   -80.53690
   42    41 S   O    _O33    42     1.22963   121.79223   141.05184
   43    41 S   CT   _C14    43     1.51055   116.60180   -40.49637
   44    43 S   HC   _H21    44     1.10077   107.89369   114.59078
   45    43 S   HC   _H22    45     1.09951   108.24976  -129.05014
   46    43 S   CT   _C13    46     1.53850   111.15141    -8.00158
   47    46 S   HC   _H5_    47     1.08787   107.10341   -60.05212
   48    46 S   CT   _C8_    48     1.56505   109.27518   179.72234
   49    48 S   HC   _H4_    49     1.09757   110.17513     3.04234
   50    48 S   CT   _C9_    50     1.53657   110.14979  -115.09996
   51    50 S   HC   _H12    51     1.09833   110.79026   179.96574
   52    50 S   HC   _H13    52     1.09766   110.82133    62.24698
   53    50 S   CT   _C10    53     1.53189   107.50110   -59.07568
   54    53 S   HC   _H14    54     1.09646   108.49619   178.76711
   55    53 S   CT   _C12    55     1.54722   110.43642    59.73851
   56    55 S   HC   _H19    56     1.09526   105.44203   112.98091
   57    55 S   HC   _H20    57     1.09679   110.80975  -132.45061
   58    53 S   CT   _C11    59     1.53464   109.20575   -63.80667
   59    58 S   HC   _H15    60     1.09470   112.09544   175.73120
   60    58 S   HC   _H16    61     1.09517   111.40562   -62.01682
   61    33 S   NT   _N5_    58     1.47053   109.40060   154.00555
   62    58 S   NP   _N4_    62     1.49719   110.65058    56.52324
   63    62 S   H    _H17    63     1.02853   109.34005    71.08021
   64    62 S   H    _H18    64     1.02888   108.57909  -174.65628
   65    48 S   CT   _C7_    65     1.54837   113.61522   123.96670
   66    65 S   HC   _H3_    66     1.09812   109.59166   178.01949
   67    65 S   CT   _C6_    67     1.52302   114.44950   -60.04476
   68    67 S   HC   _H10    68     1.09583   109.04681    74.37617
   69    67 S   HC   _H11    69     1.09425   109.26969   -42.39448
   70    67 S   CM   _C5_    70     1.49824   111.29237  -162.60913
   71    70 S   HC   _H9_    71     1.08719   117.43911    58.96097
   72    70 S   CM   _C4_    72     1.33774   123.92605  -121.83859
   73    72 S   HC   _H7_    73     1.08439   121.59867   180.00000
   74    72 S   HC   _H8_    74     1.08472   120.43075    -0.00000
  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  10   5   4   8   4  10   5   4  15   6  18
   9  15   6   5  12   8   7   3   2   9   5   4   1   8   4   3
   7   4   7   4   3   4   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    61    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    46    55    61  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    46    47    48    53    55    56    57    61  
   38    39    40    41    46    55    61  
   36    37  
   37  
    0  
   39    40    41    42    43    44    45    46    55    61  
   40    41    42    43    61  
   41    42    43    61  
   42    43    44    45    46    47    48    61  
   43    44    45    46  
   44    45    46    47    48    49    50    55    61    65  
   45    46    47    48    61  
   46    47    48    61  
   47    48    49    50    51    52    53    55    56    57    61    62    65    66    67  
   48    49    50    55    61    65  
   49    50    51    52    53    54    55    61    58    62    63    64    65    66    67    68    69    70  
   50    51    52    53    61    62    65    66    67  
   51    52    53    54    55    56    57    61    58    59    60    62    65    66    67  
   52    53    54    55    58    65  
   53    54    55    58    65  
   54    55    56    57    61    58    59    60    62    63    64    65  
   55    56    57    61    58    59    60    62  
   56    57    61    58    59    60    62  
   57    61    58  
   61    58  
   59    60    62    63    64    65    66    67    61  
   60    62    63    64    65  
   62    63    64    65  
   65  
   63    64    65    66    67    68    69    70  
   64    65    66    67  
   65    66    67  
   66    67    68    69    70    71    72  
   67    68    69    70  
   68    69    70    71    72    73    74  
   69    70    71    72  
   70    71    72  
   71    72    73    74  
   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   0.317500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0150   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0150   0.060000   1.6450   1.4500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   55   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0150   0.060000   1.6450   1.4500   0.008598240   0.268726247
   57   2.5000   0.0150   0.060000   1.6450   1.4500   0.008598240   0.268726247
   58   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   61   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   62   3.2500   0.1700  -0.200000   2.1950   1.9500   0.003973653   1.685851020
   63   0.5000   0.0300   0.310000   0.9960   0.8600   0.030040813  -0.651083722
   64   0.5000   0.0300   0.310000   0.9960   0.8600   0.030040813  -0.651083722
   65   3.5000   0.0660   0.230000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   67   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   70   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   71   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   73   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   74   2.4200   0.0300   0.115000   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   268.000  1.529
   33    61   382.000  1.448
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   317.000  1.522
   41    42   570.000  1.229
   41    43   317.000  1.522
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    46   268.000  1.529
   46    47   340.000  1.090
   46    48   268.000  1.529
   46    61   382.000  1.448
   48    49   340.000  1.090
   48    50   268.000  1.529
   48    65   268.000  1.529
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   268.000  1.529
   53    54   340.000  1.090
   53    55   268.000  1.529
   53    58   268.000  1.529
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    61   382.000  1.448
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    62   367.000  1.471
   62    63   434.000  1.010
   62    64   434.000  1.010
   62    65   367.000  1.471
   65    66   340.000  1.090
   65    67   268.000  1.529
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   317.000  1.510
   70    71   340.000  1.080
   70    72   549.000  1.340
   72    73   340.000  1.080
   72    74   340.000  1.080
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  111.63000
   29    33    61    85.00000  109.00000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    63.00000  111.10000
   33    61    46    51.80000  107.20000
   33    61    55    51.80000  107.20000
   38    33    34    37.50000  110.70000
   38    41    42    80.00000  120.40000
   38    41    43    70.00000  116.00000
   40    38    39    33.00000  107.80000
   41    38    39    35.00000  109.50000
   41    38    40    35.00000  109.50000
   41    43    44    35.00000  109.50000
   41    43    45    35.00000  109.50000
   41    43    46    63.00000  111.10000
   43    41    42    80.00000  120.40000
   43    46    47    37.50000  110.70000
   43    46    48    58.35000  112.70000
   43    46    61    56.20000  109.47000
   45    43    44    33.00000  107.80000
   46    43    44    37.50000  110.70000
   46    43    45    37.50000  110.70000
   46    48    49    37.50000  110.70000
   46    48    50    58.35000  112.70000
   46    48    65    58.35000  112.70000
   46    61    55    51.80000  107.20000
   48    46    47    37.50000  110.70000
   48    50    51    37.50000  110.70000
   48    50    52    37.50000  110.70000
   48    50    53    58.35000  112.70000
   48    65    62    80.00000  111.20000
   48    65    66    37.50000  110.70000
   48    65    67    58.35000  112.70000
   50    48    49    37.50000  110.70000
   50    53    54    37.50000  110.70000
   50    53    55    58.35000  112.70000
   50    53    58    58.35000  112.70000
   52    50    51    33.00000  107.80000
   53    50    51    37.50000  110.70000
   53    50    52    37.50000  110.70000
   53    55    56    37.50000  110.70000
   53    55    57    37.50000  110.70000
   53    55    61    56.20000  109.47000
   53    58    59    37.50000  110.70000
   53    58    60    37.50000  110.70000
   53    58    62    80.00000  111.20000
   55    53    54    37.50000  110.70000
   57    55    56    33.00000  107.80000
   61    33    34    35.00000  109.50000
   61    33    38    56.20000  109.47000
   61    46    47    35.00000  109.50000
   61    46    48    56.20000  109.47000
   61    55    56    35.00000  109.50000
   61    55    57    35.00000  109.50000
   58    53    54    37.50000  110.70000
   58    53    55    58.35000  112.70000
   58    62    63    35.00000  109.50000
   58    62    64    35.00000  109.50000
   58    62    65    75.00000  113.01200
   60    58    59    33.00000  107.80000
   62    58    59    35.00000  109.50000
   62    58    60    35.00000  109.50000
   62    65    66    35.00000  109.50000
   62    65    67    80.00000  111.20000
   64    62    63    35.00000  109.50000
   65    48    49    37.50000  110.70000
   65    48    50    58.35000  112.70000
   65    62    63    35.00000  109.50000
   65    62    64    35.00000  109.50000
   65    67    68    37.50000  110.70000
   65    67    69    37.50000  110.70000
   65    67    70    70.00000  112.02700
   67    65    66    37.50000  110.70000
   67    70    71    35.00000  117.00000
   67    70    72    70.00000  124.00000
   69    67    68    33.00000  107.80000
   70    67    68    35.00000  109.50000
   70    67    69    35.00000  109.50000
   70    72    73    35.00000  120.00000
   70    72    74    35.00000  120.00000
   72    70    71    35.00000  120.00000
   74    72    73    35.00000  117.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    61   0.01700  1.0 1.0
   24    29    33    61  -0.23550 -1.0 2.0
   24    29    33    61   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   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.56750  1.0 1.0
   29    33    38    41  -0.07550 -1.0 2.0
   29    33    38    41   0.20000  1.0 3.0
   29    33    61    46   0.23200  1.0 1.0
   29    33    61    46   0.02100 -1.0 2.0
   29    33    61    46   0.24950  1.0 3.0
   29    33    61    55   0.23200  1.0 1.0
   29    33    61    55   0.02100 -1.0 2.0
   29    33    61    55   0.24950  1.0 3.0
   33    38    41    42   0.30150 -1.0 2.0
   33    38    41    43   0.60050  1.0 1.0
   33    38    41    43   0.05600 -1.0 2.0
   33    38    41    43   0.26150  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    41  -0.11250  1.0 3.0
   34    33    61    46   0.28000  1.0 3.0
   34    33    61    55   0.28000  1.0 3.0
   38    33    61    46   0.23450  1.0 1.0
   38    33    61    46   0.02050 -1.0 2.0
   38    33    61    46   0.25250  1.0 3.0
   38    33    61    55   0.23450  1.0 1.0
   38    33    61    55   0.02050 -1.0 2.0
   38    33    61    55   0.25250  1.0 3.0
   38    41    43    44   0.00000  1.0 1.0
   38    41    43    45   0.00000  1.0 1.0
   38    41   -43    46   0.60050  1.0 1.0
   38    41   -43    46   0.05600 -1.0 2.0
   38    41   -43    46   0.26150  1.0 3.0
   39    38    41    42   0.00000  1.0 1.0
   39    38    41    43   0.00000  1.0 1.0
   40    38    41    42   0.00000  1.0 1.0
   40    38    41    43   0.00000  1.0 1.0
   41    43    46    47  -0.11250  1.0 3.0
   41    43    46    48  -0.95700  1.0 1.0
   41    43    46    48  -0.18200 -1.0 2.0
   41    43    46    48   0.29450  1.0 3.0
   41    43    46    61  -3.56550  1.0 1.0
   41    43    46    61  -0.67500 -1.0 2.0
   41    43    46    61   1.11300  1.0 3.0
   42    41    43    44   0.00000  1.0 1.0
   42    41    43    45   0.00000  1.0 1.0
   42    41    43    46   0.30150 -1.0 2.0
   43    46    48    49   0.15000  1.0 3.0
   43    46    48    50   0.56750  1.0 1.0
   43    46    48    50  -0.07550 -1.0 2.0
   43    46    48    50   0.20000  1.0 3.0
   43    46    48    65   0.56750  1.0 1.0
   43    46    48    65  -0.07550 -1.0 2.0
   43    46    48    65   0.20000  1.0 3.0
   43    46   -61    33   0.23450  1.0 1.0
   43    46   -61    33   0.02050 -1.0 2.0
   43    46   -61    33   0.25250  1.0 3.0
   43    46    61    55   0.23450  1.0 1.0
   43    46    61    55   0.02050 -1.0 2.0
   43    46    61    55   0.25250  1.0 3.0
   44    43    46    47   0.15000  1.0 3.0
   44    43    46    48   0.15000  1.0 3.0
   44    43    46    61   0.15000  1.0 3.0
   45    43    46    47   0.15000  1.0 3.0
   45    43    46    48   0.15000  1.0 3.0
   45    43    46    61   0.15000  1.0 3.0
   46    48    50    51   0.15000  1.0 3.0
   46    48    50    52   0.15000  1.0 3.0
   46    48    50    53   0.56750  1.0 1.0
   46    48    50    53  -0.07550 -1.0 2.0
   46    48    50    53   0.20000  1.0 3.0
   46    48    65    62   1.36600  1.0 1.0
   46    48    65    62  -0.11450 -1.0 2.0
   46    48    65    62   0.24250  1.0 3.0
   46    48    65    66   0.15000  1.0 3.0
   46    48    65    67   0.56750  1.0 1.0
   46    48    65    67  -0.07550 -1.0 2.0
   46    48    65    67   0.20000  1.0 3.0
   47    46    48    49   0.15000  1.0 3.0
   47    46    48    50   0.15000  1.0 3.0
   47    46    48    65   0.15000  1.0 3.0
   47    46    61    33   0.28000  1.0 3.0
   47    46    61    55   0.28000  1.0 3.0
   48    46    61    33   0.23450  1.0 1.0
   48    46    61    33   0.02050 -1.0 2.0
   48    46    61    33   0.25250  1.0 3.0
   48    46    61    55   0.23450  1.0 1.0
   48    46    61    55   0.02050 -1.0 2.0
   48    46    61    55   0.25250  1.0 3.0
   48    50    53    54   0.15000  1.0 3.0
   48    50   -53    55   0.56750  1.0 1.0
   48    50   -53    55  -0.07550 -1.0 2.0
   48    50   -53    55   0.20000  1.0 3.0
   48    50    53    58   0.56750  1.0 1.0
   48    50    53    58  -0.07550 -1.0 2.0
   48    50    53    58   0.20000  1.0 3.0
   48    65    67    68   0.15000  1.0 3.0
   48    65    67    69   0.15000  1.0 3.0
   48    65    67    70   0.34400  1.0 1.0
   48    65    67    70   0.09450 -1.0 2.0
   48    65    67    70   0.11100  1.0 3.0
   49    48    50    51   0.15000  1.0 3.0
   49    48    50    52   0.15000  1.0 3.0
   49    48    50    53   0.15000  1.0 3.0
   49    48    65    62   0.19200  1.0 3.0
   49    48    65    66   0.15000  1.0 3.0
   49    48    65    67   0.15000  1.0 3.0
   50    48    65    62   1.36600  1.0 1.0
   50    48    65    62  -0.11450 -1.0 2.0
   50    48    65    62   0.24250  1.0 3.0
   50    48    65    66   0.15000  1.0 3.0
   50    48    65    67   0.56750  1.0 1.0
   50    48    65    67  -0.07550 -1.0 2.0
   50    48    65    67   0.20000  1.0 3.0
   50    53    55    56   0.15000  1.0 3.0
   50    53    55    57   0.15000  1.0 3.0
   50    53    55    61   1.53400  1.0 1.0
   50    53    55    61  -0.09950 -1.0 2.0
   50    53    55    61   0.05700  1.0 3.0
   50    53    58    59   0.15000  1.0 3.0
   50    53    58    60   0.15000  1.0 3.0
   50    53   -58    62   1.36600  1.0 1.0
   50    53   -58    62  -0.11450 -1.0 2.0
   50    53   -58    62   0.24250  1.0 3.0
   51    50    53    54   0.15000  1.0 3.0
   51    50    53    55   0.15000  1.0 3.0
   51    50    53    58   0.15000  1.0 3.0
   52    50    53    54   0.15000  1.0 3.0
   52    50    53    55   0.15000  1.0 3.0
   52    50    53    58   0.15000  1.0 3.0
   53    55    61    33   0.23450  1.0 1.0
   53    55    61    33   0.02050 -1.0 2.0
   53    55    61    33   0.25250  1.0 3.0
   53    55   -61    46   0.23450  1.0 1.0
   53    55   -61    46   0.02050 -1.0 2.0
   53    55   -61    46   0.25250  1.0 3.0
   53    58    62    63   0.17350  1.0 3.0
   53    58    62    64   0.17350  1.0 3.0
   53    58    62    65   0.47100  1.0 1.0
   54    53    55    56   0.15000  1.0 3.0
   54    53    55    57   0.15000  1.0 3.0
   54    53    55    61   0.15000  1.0 3.0
   54    53    58    59   0.15000  1.0 3.0
   54    53    58    60   0.15000  1.0 3.0
   54    53    58    62   0.19200  1.0 3.0
   55    53    58    59   0.15000  1.0 3.0
   55    53    58    60   0.15000  1.0 3.0
   55    53    58    62   1.36600  1.0 1.0
   55    53    58    62  -0.11450 -1.0 2.0
   55    53    58    62   0.24250  1.0 3.0
   56    55    61    33   0.28000  1.0 3.0
   56    55    61    46   0.28000  1.0 3.0
   57    55    61    33   0.28000  1.0 3.0
   57    55    61    46   0.28000  1.0 3.0
   61    33    38    39   0.15000  1.0 3.0
   61    33    38    40   0.15000  1.0 3.0
   61    33   -38    41  -3.56550  1.0 1.0
   61    33   -38    41  -0.67500 -1.0 2.0
   61    33   -38    41   1.11300  1.0 3.0
   61    46    48    49   0.15000  1.0 3.0
   61    46   -48    50   1.53400  1.0 1.0
   61    46   -48    50  -0.09950 -1.0 2.0
   61    46   -48    50   0.05700  1.0 3.0
   61    46    48    65   1.53400  1.0 1.0
   61    46    48    65  -0.09950 -1.0 2.0
   61    46    48    65   0.05700  1.0 3.0
   58    53    55    56   0.15000  1.0 3.0
   58    53    55    57   0.15000  1.0 3.0
   58    53    55    61   1.53400  1.0 1.0
   58    53    55    61  -0.09950 -1.0 2.0
   58    53    55    61   0.05700  1.0 3.0
   58    62   -65    48   0.47100  1.0 1.0
   58    62    65    66   0.15000  1.0 3.0
   58    62    65    67   0.47100  1.0 1.0
   59    58    62    63   0.13050  1.0 3.0
   59    58    62    64   0.13050  1.0 3.0
   59    58    62    65   0.15000  1.0 3.0
   60    58    62    63   0.13050  1.0 3.0
   60    58    62    64   0.13050  1.0 3.0
   60    58    62    65   0.15000  1.0 3.0
   62    65    67    68   0.19200  1.0 3.0
   62    65    67    69   0.19200  1.0 3.0
   62    65    67    70  -0.47300  1.0 1.0
   62    65    67    70   0.29700 -1.0 2.0
   62    65    67    70   0.83300  1.0 3.0
   63    62    65    48   0.17350  1.0 3.0
   63    62    65    66   0.13050  1.0 3.0
   63    62    65    67   0.17350  1.0 3.0
   64    62    65    48   0.17350  1.0 3.0
   64    62    65    66   0.13050  1.0 3.0
   64    62    65    67   0.17350  1.0 3.0
   65    48    50    51   0.15000  1.0 3.0
   65    48    50    52   0.15000  1.0 3.0
   65    48   -50    53   0.56750  1.0 1.0
   65    48   -50    53  -0.07550 -1.0 2.0
   65    48   -50    53   0.20000  1.0 3.0
   65    67    70    71   0.00000  1.0 1.0
   65    67    70    72   0.09850  1.0 1.0
   65    67    70    72   0.15250 -1.0 2.0
   65    67    70    72  -0.50650  1.0 3.0
   66    65    67    68   0.15000  1.0 3.0
   66    65    67    69   0.15000  1.0 3.0
   66    65    67    70   0.15000  1.0 3.0
   67    70    72    73   7.00000 -1.0 2.0
   67    70    72    74   7.00000 -1.0 2.0
   68    67    70    71   0.33100  1.0 3.0
   68    67    70    72   0.00000  1.0 1.0
   69    67    70    71   0.33100  1.0 3.0
   69    67    70    72   0.00000  1.0 1.0
   71    70    72    73   7.00000 -1.0 2.0
   71    70    72    74   7.00000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   38    43    41    42  10.50000 -1.0 2.0
   67    71    70    72  15.00000 -1.0 2.0
   73    74    72    70  15.00000 -1.0 2.0
END
