* LIGAND DATABASE FILE (OPLS2005)
*
001      72    74    138    224     415
    1     0 S   NP   _N1_     1    28.90288    94.34313   -22.78220
    2     1 S   H    _HN1     2     1.02779   101.46693   -84.33695
    3     1 S   H    _H1_     3     1.02958    84.50364    23.29685
    4     1 S   H    _H2_     4     1.02837    27.42093   168.84345
    5     1 S   CT   _CA1     5     1.50113   135.17172   136.88148
    6     5 S   HC   _HA1     6     1.09575   105.22836    74.24052
    7     5 S   CO3  _C1_     7     1.53775   112.39267   -45.98261
    8     7 S   O2Z  _O11     8     1.26359   114.99554   -44.04656
    9     7 S   O2Z  _O12     9     1.26236   114.91750   135.13939
   10     5 S   CT   _CB1    10     1.53098   107.44653  -167.84103
   11    10 S   HC   HB11    11     1.09826   109.32472   -50.76552
   12    10 S   HC   HB12    12     1.09818   110.43319    65.78682
   13    10 S   CT   _CG1    13     1.53021   112.66587  -171.84770
   14    13 S   HC   HG11    14     1.09593   110.48587   -64.36449
   15    13 S   HC   HG12    15     1.09656   109.94007    54.86643
   16    13 S   C    _CD1    16     1.51810   112.30394   175.23371
   17    16 S   O    _OE1    17     1.22733   123.24603     0.24228
   18    16 S   N    _N2_    18     1.38657   111.66364  -179.68348
   19    18 S   H    _HN2    19     1.01590   119.04984     0.86570
   20    18 S   CT1  _CA2    20     1.46091   123.34257   179.26992
   21    20 S   HC   _HA2    21     1.09591   109.27893    -6.70201
   22    20 S   C    _C2_    22     1.53497   108.78959  -121.80515
   23    22 S   O    _O2_    23     1.23036   122.07407  -148.10823
   24    20 S   CT   _CB2    32     1.53366   111.72087   115.71028
   25    24 S   HC   HB21    33     1.09652   109.65982    60.71482
   26    24 S   HC   HB22    34     1.09569   110.93436   178.10349
   27    22 S   N    _N3_    24     1.38458   113.53480    39.48827
   28    27 S   H    _HN3    25     1.01504   118.94481    -0.96327
   29    24 S   S    _SG2    35     1.82866   114.64278   -59.24764
   30    27 S   CT   _CA3    26     1.45460   123.56550   174.65639
   31    30 S   HC   HA31    27     1.09514   109.35640    21.98767
   32    30 S   HC   HA32    28     1.09496   107.09366   139.05775
   33    29 S   CT   _C18    36     1.82809    99.77334   -66.57018
   34    33 S   HC   _H3_    37     1.09508   108.56355   -49.50793
   35    33 S   HC   _H4_    38     1.09129   106.68656    67.65359
   36    30 S   CO3  _C3_    29     1.52937   113.04217  -101.54011
   37    36 S   O2Z  _O31    30     1.26411   115.40999   -43.21345
   38    36 S   O2Z  _O32    31     1.26353   114.97067   137.67098
   39    33 S   CT   _C15    39     1.53381   111.49761  -172.00139
   40    39 S   HC   _H33    40     1.09643   111.49370   -48.23341
   41    39 S   CO4  _C6_    41     1.50815   110.44844    74.08971
   42    41 S   O    _O16    42     1.22116   125.99526   -79.04071
   43    41 S   OS   _O17    43     1.36355   109.95671    99.40299
   44    43 S   CT   _C17    44     1.44372   110.90140     3.15480
   45    44 S   HC   _H35    45     1.09777   107.25874   -98.75810
   46    44 S   CT   _C13    46     1.53924   107.52322   141.92739
   47    46 S   HC   _H31    47     1.10141   108.11605   -36.03214
   48    39 S   CT   _C16    63     1.53950   115.60139  -172.63500
   49    48 S   HC   _H34    64     1.09996   106.97516   159.12733
   50    46 S   CM   _C5_    48     1.52435   115.10333    81.50856
   51    50 S   CT   _C14    49     1.50507   110.40693   146.85927
   52    51 S   HC   _H32    50     1.09452   110.47585  -115.31082
   53    50 S   CM   _C8_    70     1.34063   126.82333   -31.41771
   54    53 S   HC   _H22    71     1.08546   120.76552   179.07486
   55    53 S   HC   _H23    72     1.08343   122.18377    -1.50805
   56    51 S   CT   _C11    51     1.52444   104.08249     4.79608
   57    56 S   HC   _H28    52     1.09547   111.85599  -150.10343
   58    56 S   HC   _H29    53     1.09907   110.08315    92.36962
   59    51 S   OH   _O18    68     1.41797   111.06626   123.54003
   60    59 S   HO   _H38    69     0.97225   107.38692  -174.97578
   61    46 S   CT   _C12    54     1.54664   117.28756  -156.90980
   62    61 S   HC   _H30    55     1.09937   108.67453    87.27483
   63    61 S   CM   _C4_    56     1.52018   115.24384   -31.97602
   64    63 S   CT   _C9_    57     1.51266   114.75331    84.41990
   65    64 S   HC   _H24    58     1.09744   109.43043    46.21845
   66    64 S   HC   _H25    59     1.09810   110.25244   161.37698
   67    63 S   CM   _C7_    65     1.34312   125.48268   -99.51837
   68    67 S   HC   _H20    66     1.08217   122.81560     1.94300
   69    67 S   HC   _H21    67     1.08590   121.06344  -178.21699
   70    64 S   CT   _C10    60     1.52673   113.89875   -77.02059
   71    70 S   HC   _H26    61     1.09751   107.61746   179.50901
   72    70 S   HC   _H27    62     1.09751   108.51574   -65.38427
  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   7   5   4   3
  11   5   4   2   1   1  13   7   8   3   9  16   7  19   8  10
   4  13  12   7   5   1   1   9   5   4   2   1   9   3   9   8
   5   4   3   1   1   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    48  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    44    70    48    49  
   35    39    40    41    48  
   39    40    41    48  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    64    70    71    72    48    49  
   41    42    43    44    70    48    49  
   42    43    44    45    46    70    48    49  
   43    44    48  
   44    45    46    47    50    61    70    48    49  
   45    46    47    50    51    56    61    62    63    64    70    71    72    48    49    53  
   46    47    50    61    70    48    49  
   47    50    51    52    56    57    58    61    62    63    64    70    48    49    67    59    53    54    55  
   50    51    56    61    62    63    48    53  
   49    50    61    63    64    65    66    70    71    72  
   64    70    71    72  
   51    52    56    57    58    61    62    63    59    60    53    54    55  
   52    56    57    58    61    62    63    59    60    53    54    55  
   56    57    58    61    59    60    53  
   54    55    56    59    61  
   55  
    0  
   57    58    61    62    63    64    67    59    60  
   58    61    62    63    59  
   61    62    63    59  
   60    61  
    0  
   62    63    64    65    66    70    67    68    69  
   63    64    67  
   64    65    66    70    71    72    67    68    69  
   65    66    70    71    72    67    68    69  
   66    70    71    72    67  
   70    71    72    67  
   68    69    70  
   69  
    0  
   71    72  
   72  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   44   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   46   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   51   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   54   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   55   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.120000   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   60   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   61   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   64   3.5000   0.0660  -0.120000   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   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   68   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   69   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   317.000  1.522
   39    48   268.000  1.529
   41    42   570.000  1.229
   41    43   214.000  1.327
   43    44   320.000  1.410
   44    45   340.000  1.090
   44    46   268.000  1.529
   44    48   268.000  1.529
   46    47   340.000  1.090
   46    50   317.000  1.510
   46    61   268.000  1.529
   50    51   317.000  1.510
   50    53   549.000  1.340
   51    52   340.000  1.090
   51    56   268.000  1.529
   51    59   320.000  1.410
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    61   268.000  1.529
   61    62   340.000  1.090
   61    63   317.000  1.510
   63    64   317.000  1.510
   63    67   549.000  1.340
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    70   268.000  1.529
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    48   268.000  1.529
   48    49   340.000  1.090
   67    68   340.000  1.080
   67    69   340.000  1.080
   59    60   553.000  0.945
   53    54   340.000  1.080
   53    55   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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    63.00000  111.10000
   33    39    48    58.35000  112.70000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    80.00000  120.40000
   39    41    43    81.00000  111.40000
   39    48    44    58.35000  112.70000
   39    48    70    58.35000  112.70000
   39    48    49    37.50000  110.70000
   41    39    40    35.00000  109.50000
   41    43    44    83.00000  116.90000
   43    41    42    83.00000  123.40000
   43    44    45    35.00000  109.50000
   43    44    46    50.00000  109.50000
   43    44    48    50.00000  109.50000
   44    46    47    37.50000  110.70000
   44    46    50    70.00000  112.02700
   44    46    61    58.35000  112.70000
   44    48    70    58.35000  112.70000
   44    48    49    37.50000  110.70000
   46    44    45    37.50000  110.70000
   46    50    51    65.00000  117.92700
   46    50    53    70.00000  124.00000
   46    61    56    58.35000  112.70000
   46    61    62    37.50000  110.70000
   46    61    63    70.00000  112.02700
   50    46    47    35.00000  109.50000
   50    51    52    35.00000  109.50000
   50    51    56    70.00000  112.02700
   50    51    59    90.00000  110.39200
   50    53    54    35.00000  120.00000
   50    53    55    35.00000  120.00000
   51    56    57    37.50000  110.70000
   51    56    58    37.50000  110.70000
   51    56    61    58.35000  112.70000
   51    59    60    55.00000  108.50000
   56    51    52    37.50000  110.70000
   56    61    62    37.50000  110.70000
   56    61    63    70.00000  112.02700
   58    56    57    33.00000  107.80000
   61    46    47    37.50000  110.70000
   61    46    50    70.00000  112.02700
   61    56    57    37.50000  110.70000
   61    56    58    37.50000  110.70000
   61    63    64    65.00000  117.92700
   61    63    67    70.00000  124.00000
   63    61    62    35.00000  109.50000
   63    64    65    35.00000  109.50000
   63    64    66    35.00000  109.50000
   63    64    70    70.00000  112.02700
   63    67    68    35.00000  120.00000
   63    67    69    35.00000  120.00000
   64    70    71    37.50000  110.70000
   64    70    72    37.50000  110.70000
   64    70    48    58.35000  112.70000
   66    64    65    33.00000  107.80000
   70    64    65    37.50000  110.70000
   70    64    66    37.50000  110.70000
   70    48    49    37.50000  110.70000
   72    70    71    33.00000  107.80000
   48    39    40    37.50000  110.70000
   48    39    41    63.00000  111.10000
   48    44    45    37.50000  110.70000
   48    44    46    58.35000  112.70000
   48    70    71    37.50000  110.70000
   48    70    72    37.50000  110.70000
   67    63    64    70.00000  124.00000
   69    67    68    35.00000  117.00000
   59    51    52    35.00000  109.50000
   59    51    56    50.00000  109.50000
   53    50    51    70.00000  124.00000
   55    53    54    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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    35   0.32350  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    39    40   0.15000  1.0 3.0
   29    33    39    41   0.56750  1.0 1.0
   29    33    39    41  -0.07550 -1.0 2.0
   29    33    39    41   0.20000  1.0 3.0
   29    33    39    48   0.44750  1.0 1.0
   29    33    39    48  -0.17800 -1.0 2.0
   29    33    39    48   0.20200  1.0 3.0
   33    39    41    42   0.30150 -1.0 2.0
   33    39    41    43   0.36750  1.0 3.0
   33    39    48    44   0.56750  1.0 1.0
   33    39    48    44  -0.07550 -1.0 2.0
   33    39    48    44   0.20000  1.0 3.0
   33    39    48    70   0.56750  1.0 1.0
   33    39    48    70  -0.07550 -1.0 2.0
   33    39    48    70   0.20000  1.0 3.0
   33    39    48    49   0.15000  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41  -0.11250  1.0 3.0
   34    33    39    48   0.15000  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41  -0.11250  1.0 3.0
   35    33    39    48   0.15000  1.0 3.0
   39    41   -43    44   1.63150  1.0 1.0
   39    41   -43    44   2.92000 -1.0 2.0
   40    39    41    42   0.00000  1.0 1.0
   40    39    41    43   0.00000  1.0 1.0
   40    39    48    44   0.15000  1.0 3.0
   40    39    48    70   0.15000  1.0 3.0
   40    39    48    49   0.15000  1.0 3.0
   41    39   -48    44  -0.95700  1.0 1.0
   41    39   -48    44  -0.18200 -1.0 2.0
   41    39   -48    44   0.29450  1.0 3.0
   41    39    48    70  -0.95700  1.0 1.0
   41    39    48    70  -0.18200 -1.0 2.0
   41    39    48    70   0.29450  1.0 3.0
   41    39    48    49  -0.11250  1.0 3.0
   41    43    44    45   0.08050  1.0 3.0
   41    43    44    46  -0.25900  1.0 1.0
   41    43    44    46  -0.47000 -1.0 2.0
   41    43    44    46   0.11750  1.0 3.0
   41    43   -44    48  -0.25900  1.0 1.0
   41    43   -44    48  -0.47000 -1.0 2.0
   41    43   -44    48   0.11750  1.0 3.0
   42    41    43    44   3.00000 -1.0 2.0
   43    44    46    47   0.23400  1.0 3.0
   43    44    46    50   0.61850  1.0 1.0
   43    44    46    50  -0.22750 -1.0 2.0
   43    44    46    50   0.15300  1.0 3.0
   43    44    46    61   0.62750  1.0 1.0
   43    44    46    61  -0.30950 -1.0 2.0
   43    44    46    61   0.27300  1.0 3.0
   43    44   -48    39   0.62750  1.0 1.0
   43    44   -48    39  -0.30950 -1.0 2.0
   43    44   -48    39   0.27300  1.0 3.0
   43    44    48    70   0.62750  1.0 1.0
   43    44    48    70  -0.30950 -1.0 2.0
   43    44    48    70   0.27300  1.0 3.0
   43    44    48    49   0.23400  1.0 3.0
   44    46    50    51   0.46850  1.0 1.0
   44    46    50    51   0.08550 -1.0 2.0
   44    46    50    51   0.09800  1.0 3.0
   44    46    50    53   0.09850  1.0 1.0
   44    46    50    53   0.15250 -1.0 2.0
   44    46    50    53  -0.50650  1.0 3.0
   44    46    61    56   0.56750  1.0 1.0
   44    46    61    56  -0.07550 -1.0 2.0
   44    46    61    56   0.20000  1.0 3.0
   44    46    61    62   0.15000  1.0 3.0
   44    46    61    63   0.34400  1.0 1.0
   44    46    61    63   0.09450 -1.0 2.0
   44    46    61    63   0.11100  1.0 3.0
   45    44    46    47   0.15000  1.0 3.0
   45    44    46    50   0.15000  1.0 3.0
   45    44    46    61   0.15000  1.0 3.0
   45    44    48    39   0.15000  1.0 3.0
   45    44    48    70   0.15000  1.0 3.0
   45    44    48    49   0.15000  1.0 3.0
   46    44    48    39   0.56750  1.0 1.0
   46    44    48    39  -0.07550 -1.0 2.0
   46    44    48    39   0.20000  1.0 3.0
   46    44    48    70   0.56750  1.0 1.0
   46    44    48    70  -0.07550 -1.0 2.0
   46    44    48    70   0.20000  1.0 3.0
   46    44    48    49   0.15000  1.0 3.0
   46    50    51    52   0.34800  1.0 3.0
   46    50   -51    56   0.46850  1.0 1.0
   46    50   -51    56   0.08550 -1.0 2.0
   46    50   -51    56   0.09800  1.0 3.0
   46    50    51    59   0.18000  1.0 1.0
   46    50    51    59   0.16450 -1.0 2.0
   46    50    51    59   0.04450  1.0 3.0
   46    50    53    54   7.00000 -1.0 2.0
   46    50    53    55   7.00000 -1.0 2.0
   46    61    63    64   0.46850  1.0 1.0
   46    61    63    64   0.08550 -1.0 2.0
   46    61    63    64   0.09800  1.0 3.0
   46    61    63    67   0.09850  1.0 1.0
   46    61    63    67   0.15250 -1.0 2.0
   46    61    63    67  -0.50650  1.0 3.0
   47    46    50    51   0.34800  1.0 3.0
   47    46    50    53   0.00000  1.0 1.0
   47    46    61    56   0.15000  1.0 3.0
   47    46    61    62   0.15000  1.0 3.0
   47    46    61    63   0.15000  1.0 3.0
   50    46   -61    56   0.34400  1.0 1.0
   50    46   -61    56   0.09450 -1.0 2.0
   50    46   -61    56   0.11100  1.0 3.0
   50    46    61    62   0.15000  1.0 3.0
   50    46    61    63   0.31000  1.0 1.0
   50    46    61    63   0.14700 -1.0 2.0
   50    46    61    63   0.07550  1.0 3.0
   50    51    56    57   0.15000  1.0 3.0
   50    51    56    58   0.15000  1.0 3.0
   50    51   -56    61   0.34400  1.0 1.0
   50    51   -56    61   0.09450 -1.0 2.0
   50    51   -56    61   0.11100  1.0 3.0
   50    51    59    60  -0.07800  1.0 1.0
   50    51    59    60  -0.21500 -1.0 2.0
   50    51    59    60  -0.03150  1.0 3.0
   51    50    53    54   7.00000 -1.0 2.0
   51    50    53    55   7.00000 -1.0 2.0
   51    56   -61    46   0.56750  1.0 1.0
   51    56   -61    46  -0.07550 -1.0 2.0
   51    56   -61    46   0.20000  1.0 3.0
   51    56    61    62   0.15000  1.0 3.0
   51    56    61    63   0.34400  1.0 1.0
   51    56    61    63   0.09450 -1.0 2.0
   51    56    61    63   0.11100  1.0 3.0
   52    51    56    57   0.15000  1.0 3.0
   52    51    56    58   0.15000  1.0 3.0
   52    51    56    61   0.15000  1.0 3.0
   52    51    59    60   0.19450  1.0 3.0
   56    51    59    60  -0.11600  1.0 1.0
   56    51    59    60  -0.09450 -1.0 2.0
   56    51    59    60   0.21250  1.0 3.0
   56    61    63    64   0.46850  1.0 1.0
   56    61    63    64   0.08550 -1.0 2.0
   56    61    63    64   0.09800  1.0 3.0
   56    61    63    67   0.09850  1.0 1.0
   56    61    63    67   0.15250 -1.0 2.0
   56    61    63    67  -0.50650  1.0 3.0
   57    56    61    46   0.15000  1.0 3.0
   57    56    61    62   0.15000  1.0 3.0
   57    56    61    63   0.15000  1.0 3.0
   58    56    61    46   0.15000  1.0 3.0
   58    56    61    62   0.15000  1.0 3.0
   58    56    61    63   0.15000  1.0 3.0
   61    46   -50    51   0.46850  1.0 1.0
   61    46   -50    51   0.08550 -1.0 2.0
   61    46   -50    51   0.09800  1.0 3.0
   61    46    50    53   0.09850  1.0 1.0
   61    46    50    53   0.15250 -1.0 2.0
   61    46    50    53  -0.50650  1.0 3.0
   61    63    64    65   0.34800  1.0 3.0
   61    63    64    66   0.34800  1.0 3.0
   61    63    64    70   0.46850  1.0 1.0
   61    63    64    70   0.08550 -1.0 2.0
   61    63    64    70   0.09800  1.0 3.0
   61    63    67    68   7.00000 -1.0 2.0
   61    63    67    69   7.00000 -1.0 2.0
   62    61    63    64   0.34800  1.0 3.0
   62    61    63    67   0.00000  1.0 1.0
   63    64    70    71   0.15000  1.0 3.0
   63    64    70    72   0.15000  1.0 3.0
   63    64    70    48   0.34400  1.0 1.0
   63    64    70    48   0.09450 -1.0 2.0
   63    64    70    48   0.11100  1.0 3.0
   64    63    67    68   7.00000 -1.0 2.0
   64    63    67    69   7.00000 -1.0 2.0
   64    70    48    39   0.56750  1.0 1.0
   64    70    48    39  -0.07550 -1.0 2.0
   64    70    48    39   0.20000  1.0 3.0
   64    70    48    44   0.56750  1.0 1.0
   64    70    48    44  -0.07550 -1.0 2.0
   64    70    48    44   0.20000  1.0 3.0
   64    70    48    49   0.15000  1.0 3.0
   65    64    70    71   0.15000  1.0 3.0
   65    64    70    72   0.15000  1.0 3.0
   65    64    70    48   0.15000  1.0 3.0
   66    64    70    71   0.15000  1.0 3.0
   66    64    70    72   0.15000  1.0 3.0
   66    64    70    48   0.15000  1.0 3.0
   71    70    48    39   0.15000  1.0 3.0
   71    70    48    44   0.15000  1.0 3.0
   71    70    48    49   0.15000  1.0 3.0
   72    70    48    39   0.15000  1.0 3.0
   72    70    48    44   0.15000  1.0 3.0
   72    70    48    49   0.15000  1.0 3.0
   48    39    41    42   0.30150 -1.0 2.0
   48    39   -41    43   0.36750  1.0 3.0
   48    44    46    47   0.15000  1.0 3.0
   48    44    46    50   0.34400  1.0 1.0
   48    44    46    50   0.09450 -1.0 2.0
   48    44    46    50   0.11100  1.0 3.0
   48    44    46    61   0.56750  1.0 1.0
   48    44    46    61  -0.07550 -1.0 2.0
   48    44    46    61   0.20000  1.0 3.0
   67    63    64    65   0.00000  1.0 1.0
   67    63    64    66   0.00000  1.0 1.0
   67    63    64    70   0.09850  1.0 1.0
   67    63    64    70   0.15250 -1.0 2.0
   67    63    64    70  -0.50650  1.0 3.0
   59    51    56    57   0.23400  1.0 3.0
   59    51    56    58   0.23400  1.0 3.0
   59    51    56    61   0.86500  1.0 1.0
   59    51    56    61  -0.17500 -1.0 2.0
   59    51    56    61   0.20800  1.0 3.0
   53    50    51    52   0.00000  1.0 1.0
   53    50    51    56   0.09850  1.0 1.0
   53    50    51    56   0.15250 -1.0 2.0
   53    50    51    56  -0.50650  1.0 3.0
   53    50    51    59   0.67800  1.0 1.0
   53    50    51    59   0.47050 -1.0 2.0
   53    50    51    59  -0.62500  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
   38    30    36    37  10.50000 -1.0 2.0
   39    43    41    42  10.50000 -1.0 2.0
   46    51    50    53   1.10000 -1.0 2.0
   61    64    63    67   1.10000 -1.0 2.0
   68    69    67    63   1.10000 -1.0 2.0
   54    55    53    50   1.10000 -1.0 2.0
END
