* LIGAND DATABASE FILE (OPLS2005)
*
001      74    75    138    213     410
    1     0 S   NP   _N1_     1    28.98772    94.07490   -24.80436
    2     1 S   H    _HN1     2     1.02786   113.71613   -95.62149
    3     1 S   H    _H1_     3     1.02949    85.79319    12.60055
    4     1 S   H    _H2_     4     1.02828    21.43502  -174.03211
    5     1 S   CT   _CA1     5     1.50115   122.47157   124.16252
    6     5 S   HC   _HA1     6     1.09572   105.19629    79.39845
    7     5 S   CO3  _C1_     7     1.53791   112.44599   -40.84380
    8     7 S   O2Z  _O11     8     1.26374   115.00701   -42.81581
    9     7 S   O2Z  _O12     9     1.26239   114.94804   136.29944
   10     5 S   CT   _CB1    10     1.53078   107.41856  -162.61525
   11    10 S   HC   HB11    11     1.09833   109.38613   -49.62331
   12    10 S   HC   HB12    12     1.09812   110.44516    66.98851
   13    10 S   CT   _CG1    13     1.52990   112.60103  -170.59285
   14    13 S   HC   HG11    14     1.09582   110.63274   -65.46648
   15    13 S   HC   HG12    15     1.09669   109.78847    53.76642
   16    13 S   C    _CD1    16     1.51800   112.21346   174.23211
   17    16 S   O    _OE1    17     1.22736   123.28156     7.02856
   18    16 S   N    _N2_    18     1.38646   111.67726  -173.10198
   19    18 S   H    _HN2    19     1.01581   118.97644     1.61447
   20    18 S   CT1  _CA2    20     1.46173   123.38451   177.73428
   21    20 S   HC   _HA2    21     1.09746   109.32965     2.82743
   22    20 S   C    _C2_    22     1.53530   108.77980  -112.63952
   23    22 S   O    _O2_    23     1.23058   122.26518  -148.64616
   24    20 S   CT   _CB2    32     1.53267   111.60201   124.73435
   25    24 S   HC   HB21    33     1.09593   110.30420    56.10928
   26    24 S   HC   HB22    34     1.09395   110.04997   175.16463
   27    22 S   N    _N3_    24     1.38323   113.73117    38.87518
   28    27 S   H    _HN3    25     1.01581   119.59016    -3.43581
   29    24 S   S    _SG2    35     1.82713   111.45444   -64.52422
   30    27 S   CT   _CA3    26     1.45281   123.20097   177.05596
   31    30 S   HC   HA31    27     1.09550   107.52561   -64.19306
   32    30 S   HC   HA32    28     1.09557   107.96664    52.24034
   33    29 S   CT   _C10    36     1.85559    99.77150  -174.33185
   34    33 S   HC   _H3_    37     1.09930   103.34863   -14.18604
   35    30 S   CO3  _C3_    29     1.52956   114.08608   174.23374
   36    35 S   O2Z  _O31    30     1.26375   116.07426    -0.40686
   37    35 S   O2Z  _O32    31     1.26429   114.41138   179.64668
   38    33 S   CT   _C11    38     1.56463   114.80590   100.63662
   39    38 S   HC   _H4_    39     1.08728   109.53541   137.70437
   40    33 S   CT   _C9_    64     1.58061   110.93264  -124.61683
   41    38 S   CT   _C12    40     1.54251   120.62360     7.83504
   42    41 S   HC   _H5_    41     1.09285   113.40355    26.07663
   43    40 S   CT   _C18    65     1.53855   111.77113   176.74262
   44    43 S   HC   _H20    66     1.09624   110.61991   -51.04908
   45    43 S   HC   _H21    67     1.09664   110.71826  -168.34447
   46    43 S   HC   _H22    68     1.09209   113.28773    70.72670
   47    40 S   OH   _O35    69     1.45604   103.98239    64.61863
   48    47 S   HO   _H23    70     0.97242   108.41205   175.12010
   49    41 S   CM   _C15    42     1.49099   100.53146   -92.99404
   50    41 S   CT   _C13    49     1.55087   113.13965   149.33448
   51    50 S   HC   _H14    50     1.09823   109.60051   153.59671
   52    50 S   HC   _H15    51     1.09782   110.58485    36.85375
   53    49 S   CO4  _C17    43     1.47158   109.28220   -22.81291
   54    53 S   O    _O33    44     1.21689   127.23776  -169.41894
   55    49 S   CM   _C16    46     1.33552   128.27504   154.30550
   56    55 S   HC   _H18    47     1.08494   120.72859     1.53315
   57    55 S   HC   _H19    48     1.08507   121.72104  -178.28217
   58    50 S   CT   _C14    52     1.54179   113.35166   -87.13560
   59    58 S   HC   _H16    53     1.09807   108.89519   -63.07042
   60    58 S   HC   _H17    54     1.09698   109.39953  -177.80376
   61    38 S   OS   _O34    45     1.45995   107.06529  -110.70127
   62    58 S   CM   _C5_    55     1.51131   112.84209    59.76132
   63    62 S   CM   _C6_    56     1.34691   118.95385   -90.86732
   64    63 S   HC   _H9_    57     1.08986   117.97527    -5.97527
   65    62 S   CT   _C4_    71     1.50294   115.32241    85.37401
   66    65 S   HC   _H6_    72     1.09445   110.51231   -63.40677
   67    65 S   HC   _H7_    73     1.09193   113.40852   175.30339
   68    65 S   HC   _H8_    74     1.09536   109.92363    56.01350
   69    63 S   CT   _C7_    58     1.49335   127.76394   169.04787
   70    69 S   HC   _H10    59     1.09211   112.99871    -1.36816
   71    69 S   HC   _H11    60     1.09749   107.32443   114.97184
   72    69 S   CT   _C8_    61     1.53620   112.91173  -126.18017
   73    72 S   HC   _H12    62     1.10070   105.57868  -169.50023
   74    72 S   HC   _H13    63     1.09656   109.41588   -59.09795
  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  10   5   4   3
  20   8   2   1   1  16   7  15  15   8   9   4   3   2   5   1
  10  11   5   4   5   2   3   1   1  10   4   3   1  10  11   5
   4   2   1   1   5   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    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    41    61    72    40    43    47  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    41    42    49    53    61    50    69    72    73    74    40    43    44    45    46    47    48  
   38    39    41    61    72    40    43    47  
   36    37  
   37  
    0  
   39    41    42    49    53    54    61    55    50    51    52    58    72    40    43    47  
   41    42    49    53    61    50    40  
   43    44    45    46    47    48    41    61    63    69    70    71    72    73    74  
   42    49    53    54    61    55    56    57    50    51    52    58    59    60    62  
   49    53    61    55    50    51    52    58  
   44    45    46    47    48    69    72    73    74  
   45    46    47    72  
   46    47    72  
   47    72  
   48    69    72    73    74  
   72  
   53    54    61    55    56    57    50    51    52    58  
   51    52    58    59    60    62    63    65    53    55    61  
   52    58    59    60    62  
   58    59    60    62  
   54    61    55    56    57  
   61    55  
   56    57    61  
   57  
    0  
   59    60    62    63    64    69    65    66    67    68  
   60    62    63    65  
   62    63    65  
    0  
   63    64    69    70    71    72    65    66    67    68  
   64    69    70    71    72    73    74    65    66    67    68  
   69    70    71    72    65  
   66    67    68    69  
   67    68  
   68  
    0  
   70    71    72    73    74  
   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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   40   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   41   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   48   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   49   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   50   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   55   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   62   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   63   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   64   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   268.000  1.529
   33    40   268.000  1.529
   38    39   340.000  1.090
   38    41   268.000  1.529
   38    61   320.000  1.410
   41    42   340.000  1.090
   41    49   317.000  1.510
   41    50   268.000  1.529
   49    53   320.000  1.462
   49    55   549.000  1.340
   53    54   570.000  1.229
   53    61   214.000  1.327
   55    56   340.000  1.080
   55    57   340.000  1.080
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    58   268.000  1.529
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    62   317.000  1.510
   62    63   549.000  1.340
   62    65   317.000  1.510
   63    64   340.000  1.080
   63    69   317.000  1.510
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   268.000  1.529
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    40   268.000  1.529
   40    43   268.000  1.529
   40    47   320.000  1.410
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    46   340.000  1.090
   47    48   553.000  0.945
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    41    58.35000  112.70000
   33    38    61    50.00000  109.50000
   33    40    72    58.35000  112.70000
   33    40    43    58.35000  112.70000
   33    40    47    50.00000  109.50000
   38    33    34    37.50000  110.70000
   38    41    42    37.50000  110.70000
   38    41    49    70.00000  112.02700
   38    41    50    58.35000  112.70000
   38    61    53    83.00000  116.90000
   41    38    39    37.50000  110.70000
   41    49    53    65.00000  116.34900
   41    49    55    70.00000  124.00000
   41    50    51    37.50000  110.70000
   41    50    52    37.50000  110.70000
   41    50    58    58.35000  112.70000
   49    41    42    35.00000  109.50000
   49    53    54    80.00000  123.72100
   49    53    61    90.00000  111.29400
   49    55    56    35.00000  120.00000
   49    55    57    35.00000  120.00000
   61    38    39    35.00000  109.50000
   61    38    41    50.00000  109.50000
   61    53    54    83.00000  123.40000
   55    49    53    65.00000  118.96000
   57    55    56    35.00000  117.00000
   50    41    42    37.50000  110.70000
   50    41    49    70.00000  112.02700
   50    58    59    37.50000  110.70000
   50    58    60    37.50000  110.70000
   50    58    62    70.00000  112.02700
   52    50    51    33.00000  107.80000
   58    50    51    37.50000  110.70000
   58    50    52    37.50000  110.70000
   58    62    63    70.00000  124.00000
   58    62    65    65.00000  117.92700
   60    58    59    33.00000  107.80000
   62    58    59    35.00000  109.50000
   62    58    60    35.00000  109.50000
   62    63    64    35.00000  120.00000
   62    63    69    70.00000  124.00000
   62    65    66    35.00000  109.50000
   62    65    67    35.00000  109.50000
   62    65    68    35.00000  109.50000
   63    69    70    35.00000  109.50000
   63    69    71    35.00000  109.50000
   63    69    72    70.00000  112.02700
   69    63    64    35.00000  117.00000
   69    72    73    37.50000  110.70000
   69    72    74    37.50000  110.70000
   69    72    40    58.35000  112.70000
   71    69    70    33.00000  107.80000
   72    69    70    37.50000  110.70000
   72    69    71    37.50000  110.70000
   72    40    43    58.35000  112.70000
   72    40    47    50.00000  109.50000
   74    72    73    33.00000  107.80000
   40    33    34    37.50000  110.70000
   40    33    38    58.35000  112.70000
   40    72    73    37.50000  110.70000
   40    72    74    37.50000  110.70000
   40    43    44    37.50000  110.70000
   40    43    45    37.50000  110.70000
   40    43    46    37.50000  110.70000
   40    47    48    55.00000  108.50000
   45    43    44    33.00000  107.80000
   46    43    44    33.00000  107.80000
   46    43    45    33.00000  107.80000
   47    40    43    50.00000  109.50000
   65    62    63    70.00000  124.00000
   67    65    66    33.00000  107.80000
   68    65    66    33.00000  107.80000
   68    65    67    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38   0.01700  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    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   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    41   0.44750  1.0 1.0
   29    33    38    41  -0.17800 -1.0 2.0
   29    33    38    41   0.20200  1.0 3.0
   29    33    38    61   0.56750  1.0 1.0
   29    33    38    61  -0.07550 -1.0 2.0
   29    33    38    61   0.20000  1.0 3.0
   29    33    40    72   0.44750  1.0 1.0
   29    33    40    72  -0.17800 -1.0 2.0
   29    33    40    72   0.20200  1.0 3.0
   29    33    40    43   0.44750  1.0 1.0
   29    33    40    43  -0.17800 -1.0 2.0
   29    33    40    43   0.20200  1.0 3.0
   29    33    40    47   0.56750  1.0 1.0
   29    33    40    47  -0.07550 -1.0 2.0
   29    33    40    47   0.20000  1.0 3.0
   33    38    41    42   0.15000  1.0 3.0
   33    38    41    49   0.34400  1.0 1.0
   33    38    41    49   0.09450 -1.0 2.0
   33    38    41    49   0.11100  1.0 3.0
   33    38    41    50   0.56750  1.0 1.0
   33    38    41    50  -0.07550 -1.0 2.0
   33    38    41    50   0.20000  1.0 3.0
   33    38    61    53  -0.25900  1.0 1.0
   33    38    61    53  -0.47000 -1.0 2.0
   33    38    61    53   0.11750  1.0 3.0
   33    40    43    44   0.15000  1.0 3.0
   33    40    43    45   0.15000  1.0 3.0
   33    40    43    46   0.15000  1.0 3.0
   33    40    47    48  -0.11600  1.0 1.0
   33    40    47    48  -0.09450 -1.0 2.0
   33    40    47    48   0.21250  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    41   0.15000  1.0 3.0
   34    33    38    61   0.23400  1.0 3.0
   34    33    40    72   0.15000  1.0 3.0
   34    33    40    43   0.15000  1.0 3.0
   34    33    40    47   0.23400  1.0 3.0
   38    33    40    72   0.56750  1.0 1.0
   38    33    40    72  -0.07550 -1.0 2.0
   38    33    40    72   0.20000  1.0 3.0
   38    33    40    43   0.56750  1.0 1.0
   38    33    40    43  -0.07550 -1.0 2.0
   38    33    40    43   0.20000  1.0 3.0
   38    33    40    47   0.86500  1.0 1.0
   38    33    40    47  -0.17500 -1.0 2.0
   38    33    40    47   0.20800  1.0 3.0
   38    41   -49    53   0.09700  1.0 1.0
   38    41   -49    53   0.15600 -1.0 2.0
   38    41   -49    53  -0.50800  1.0 3.0
   38    41    49    55   0.09850  1.0 1.0
   38    41    49    55   0.15250 -1.0 2.0
   38    41    49    55  -0.50650  1.0 3.0
   38    41    50    51   0.15000  1.0 3.0
   38    41    50    52   0.15000  1.0 3.0
   38    41    50    58   0.56750  1.0 1.0
   38    41    50    58  -0.07550 -1.0 2.0
   38    41    50    58   0.20000  1.0 3.0
   39    38    41    42   0.15000  1.0 3.0
   39    38    41    49   0.15000  1.0 3.0
   39    38    41    50   0.15000  1.0 3.0
   39    38    61    53   0.08050  1.0 3.0
   41    38   -61    53  -0.25900  1.0 1.0
   41    38   -61    53  -0.47000 -1.0 2.0
   41    38   -61    53   0.11750  1.0 3.0
   41    49    53    54  -0.64400  1.0 1.0
   41    49    53    54   0.26850 -1.0 2.0
   41    49   -53    61  -0.15000  1.0 1.0
   41    49   -53    61   0.89550 -1.0 2.0
   41    49   -53    61  -0.06900  1.0 3.0
   41    49    55    56   7.00000 -1.0 2.0
   41    49    55    57   7.00000 -1.0 2.0
   41    50    58    59   0.15000  1.0 3.0
   41    50    58    60   0.15000  1.0 3.0
   41    50    58    62   0.34400  1.0 1.0
   41    50    58    62   0.09450 -1.0 2.0
   41    50    58    62   0.11100  1.0 3.0
   42    41    49    53   0.15000  1.0 3.0
   42    41    49    55   0.00000  1.0 1.0
   42    41    50    51   0.15000  1.0 3.0
   42    41    50    52   0.15000  1.0 3.0
   42    41    50    58   0.15000  1.0 3.0
   49    41    50    51   0.15000  1.0 3.0
   49    41    50    52   0.15000  1.0 3.0
   49    41    50    58   0.34400  1.0 1.0
   49    41    50    58   0.09450 -1.0 2.0
   49    41    50    58   0.11100  1.0 3.0
   49    53   -61    38   2.00000 -1.0 2.0
   53    49    55    56   7.00000 -1.0 2.0
   53    49    55    57   7.00000 -1.0 2.0
   54    53    61    38   3.00000 -1.0 2.0
   61    38    41    42   0.23400  1.0 3.0
   61    38   -41    49   0.61850  1.0 1.0
   61    38   -41    49  -0.22750 -1.0 2.0
   61    38   -41    49   0.15300  1.0 3.0
   61    38    41    50   0.62750  1.0 1.0
   61    38    41    50  -0.30950 -1.0 2.0
   61    38    41    50   0.27300  1.0 3.0
   55    49    53    54   1.00000 -1.0 2.0
   55    49    53    61  -0.56150  1.0 1.0
   55    49    53    61   2.19150 -1.0 2.0
   50    41    49    53   0.09700  1.0 1.0
   50    41    49    53   0.15600 -1.0 2.0
   50    41    49    53  -0.50800  1.0 3.0
   50    41    49    55   0.09850  1.0 1.0
   50    41    49    55   0.15250 -1.0 2.0
   50    41    49    55  -0.50650  1.0 3.0
   50    58    62    63   0.09850  1.0 1.0
   50    58    62    63   0.15250 -1.0 2.0
   50    58    62    63  -0.50650  1.0 3.0
   50    58    62    65   0.46850  1.0 1.0
   50    58    62    65   0.08550 -1.0 2.0
   50    58    62    65   0.09800  1.0 3.0
   51    50    58    59   0.15000  1.0 3.0
   51    50    58    60   0.15000  1.0 3.0
   51    50    58    62   0.15000  1.0 3.0
   52    50    58    59   0.15000  1.0 3.0
   52    50    58    60   0.15000  1.0 3.0
   52    50    58    62   0.15000  1.0 3.0
   58    62    63    64   7.00000 -1.0 2.0
   58    62    63    69   7.00000 -1.0 2.0
   58    62    65    66   0.34800  1.0 3.0
   58    62    65    67   0.34800  1.0 3.0
   58    62    65    68   0.34800  1.0 3.0
   59    58    62    63   0.00000  1.0 1.0
   59    58    62    65   0.34800  1.0 3.0
   60    58    62    63   0.00000  1.0 1.0
   60    58    62    65   0.34800  1.0 3.0
   62    63    69    70   0.00000  1.0 1.0
   62    63    69    71   0.00000  1.0 1.0
   62    63    69    72   0.09850  1.0 1.0
   62    63    69    72   0.15250 -1.0 2.0
   62    63    69    72  -0.50650  1.0 3.0
   63    62    65    66   0.00000  1.0 1.0
   63    62    65    67   0.00000  1.0 1.0
   63    62    65    68   0.00000  1.0 1.0
   63    69    72    73   0.15000  1.0 3.0
   63    69    72    74   0.15000  1.0 3.0
   63    69    72    40   0.34400  1.0 1.0
   63    69    72    40   0.09450 -1.0 2.0
   63    69    72    40   0.11100  1.0 3.0
   64    63    69    70   0.33100  1.0 3.0
   64    63    69    71   0.33100  1.0 3.0
   64    63    69    72   0.00000  1.0 1.0
   69    72    40    33   0.56750  1.0 1.0
   69    72    40    33  -0.07550 -1.0 2.0
   69    72    40    33   0.20000  1.0 3.0
   69    72    40    43   0.56750  1.0 1.0
   69    72    40    43  -0.07550 -1.0 2.0
   69    72    40    43   0.20000  1.0 3.0
   69    72    40    47   0.86500  1.0 1.0
   69    72    40    47  -0.17500 -1.0 2.0
   69    72    40    47   0.20800  1.0 3.0
   70    69    72    73   0.15000  1.0 3.0
   70    69    72    74   0.15000  1.0 3.0
   70    69    72    40   0.15000  1.0 3.0
   71    69    72    73   0.15000  1.0 3.0
   71    69    72    74   0.15000  1.0 3.0
   71    69    72    40   0.15000  1.0 3.0
   72    40    43    44   0.15000  1.0 3.0
   72    40    43    45   0.15000  1.0 3.0
   72    40    43    46   0.15000  1.0 3.0
   72    40    47    48  -0.11600  1.0 1.0
   72    40    47    48  -0.09450 -1.0 2.0
   72    40    47    48   0.21250  1.0 3.0
   73    72    40    33   0.15000  1.0 3.0
   73    72    40    43   0.15000  1.0 3.0
   73    72    40    47   0.23400  1.0 3.0
   74    72    40    33   0.15000  1.0 3.0
   74    72    40    43   0.15000  1.0 3.0
   74    72    40    47   0.23400  1.0 3.0
   40    33    38    39   0.15000  1.0 3.0
   40    33    38    41   0.56750  1.0 1.0
   40    33    38    41  -0.07550 -1.0 2.0
   40    33    38    41   0.20000  1.0 3.0
   40    33    38    61   0.62750  1.0 1.0
   40    33    38    61  -0.30950 -1.0 2.0
   40    33    38    61   0.27300  1.0 3.0
   43    40    47    48  -0.11600  1.0 1.0
   43    40    47    48  -0.09450 -1.0 2.0
   43    40    47    48   0.21250  1.0 3.0
   47    40    43    44   0.23400  1.0 3.0
   47    40    43    45   0.23400  1.0 3.0
   47    40    43    46   0.23400  1.0 3.0
   65    62    63    64   7.00000 -1.0 2.0
   65    62    63    69   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
   41    53    49    55   1.10000 -1.0 2.0
   49    61    53    54  10.50000 -1.0 2.0
   56    57    55    49   1.10000 -1.0 2.0
   58    65    62    63   1.10000 -1.0 2.0
   69    64    63    62   1.10000 -1.0 2.0
END
