* LIGAND DATABASE FILE (OPLS2005)
*
001      67    68    121    184     354
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02048   105.76218   -27.12064
    3     1 S   H    _H1_     3     1.02132    63.87859    76.36152
    4     1 S   H    _H2_     4     1.02073    48.58189  -128.34426
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04748   118.84952     8.59078
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08457   106.27517   -11.11459
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    33     1.08519   110.56213    58.83396
   26    24 S   HC   HB22    34     1.08612   109.94660   179.13182
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C13    36     1.84156    97.55847   161.84627
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CM   _C5_    37     1.51673   108.35885    79.97058
   38    33 S   CM   _C9_    49     1.51320   108.66275  -157.64161
   39    33 S   OH   _O18    66     1.43048   110.36386   -38.72074
   40    39 S   HO   _H33    67     0.96819   106.20388   178.66353
   41    37 S   CM   _C4_    38     1.34689   122.69269   -85.69644
   42    41 S   HC   _H20    39     1.08178   123.63919     1.65458
   43    38 S   C    _C10    50     1.48144   117.29242    79.46386
   44    43 S   O    _O15    51     1.20751   123.86887   -91.37591
   45    41 S   OS   _O16    40     1.36951   127.07544   179.74359
   46    43 S   OH   _O17    52     1.34342   108.90001    88.61652
   47    46 S   HO   _H32    53     0.98146   111.30222   180.00000
   48    45 S   CT   _C12    41     1.43469   115.09329    10.61680
   49    48 S   HC   _H22    42     1.09698   105.94454  -157.01431
   50    48 S   CT   _C11    43     1.54480   112.91505   -38.44119
   51    50 S   HC   _H21    44     1.09556   106.35186   174.33988
   52    48 S   CT   _C16    62     1.53196   109.13205    88.32438
   53    52 S   HC   _H29    63     1.08772   109.58348   -65.85401
   54    52 S   HC   _H30    64     1.08637   109.62461   174.09824
   55    52 S   HC   _H31    65     1.08743   109.56248    54.10997
   56    37 S   CM   _C6_    45     1.46544   117.22717    92.48702
   57    50 S   CT   _C15    58     1.53524   111.33463   -68.98686
   58    57 S   HC   _H26    59     1.08555   109.41256    63.92639
   59    57 S   HC   _H27    60     1.08695   109.40436   -56.06844
   60    57 S   HC   _H28    61     1.08651   109.43166  -176.04374
   61    56 S   CM   _C7_    46     1.35770   121.59989    17.47677
   62    61 S   CMA  _C8_    47     1.50076   120.64722     5.22738
   63    62 S   OM   _O14    48     1.26430   112.18198   163.81684
   64    61 S   CT   _C14    54     1.52286   120.88558  -173.93974
   65    64 S   HC   _H23    55     1.07999   108.34447    90.05708
   66    64 S   HC   _H24    56     1.08055   108.38235   -30.17720
   67    64 S   HC   _H25    57     1.08035   108.31570  -149.79182
  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   2   1   1  15  12   5   1   8   3   6   3  10   2   1  13
   8  13   7   5   2   1   1  11   4   2   1   1   6   5   1   3
   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    41    56    62    38    43    39    40  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    41    42    45    50    56    61    62    63    38    43    44    46    39    40  
   35    36  
   36  
    0  
   41    42    45    48    50    51    56    61    62    38    43    64    57    39    40  
   43    44    46    47    64    39    40    41    56    61    62    63  
   40    41    43    56    62  
    0  
   42    45    48    49    50    56    61    52  
   45    48    56  
   44    46    47    61    62    63  
   46    47    62  
   48    49    50    51    56    57    52    53    54    55  
   47    62  
    0  
   49    50    51    56    61    57    58    59    60    52    53    54    55  
   50    51    56    57    52    53    54    55  
   51    56    61    62    64    57    58    59    60    52    53    54    55  
   56    61    57    58    59    60    52  
   53    54    55    56    57  
   54    55  
   55  
    0  
   61    62    63    64    65    66    67    57    58    59    60  
   58    59    60    61  
   59    60  
   60  
    0  
   62    63    64    65    66    67  
   63    64    65    66    67  
   64  
   65    66    67  
   66    67  
   67  
    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   0.432500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   39   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   40   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   41   3.5500   0.0760  -0.030000   2.0020   1.7750   0.023028004  -0.852763146
   42   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   43   3.7500   0.1050   0.520000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.440000   1.9750   1.7500   0.001000000  -0.126889456
   45   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   46   3.0000   0.1700  -0.530000   1.7660   1.5600   0.021068034  -0.322181743
   47   0.5000   0.0300   0.450000   0.9960   0.8600   0.030040813  -0.651083722
   48   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   57   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   62   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   63   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   64   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    38   317.000  1.510
   33    39   320.000  1.410
   37    41   549.000  1.340
   37    56   380.000  1.444
   41    42   340.000  1.080
   41    45   440.000  1.360
   45    48   320.000  1.410
   48    49   340.000  1.090
   48    50   268.000  1.529
   48    52   268.000  1.529
   50    51   340.000  1.090
   50    56   317.000  1.510
   50    57   268.000  1.529
   56    61   549.000  1.340
   61    62   465.000  1.376
   61    64   317.000  1.510
   62    63   745.000  1.250
   62    38   465.000  1.376
   38    43   410.000  1.444
   43    44   570.000  1.229
   43    46   450.000  1.364
   46    47   553.000  0.945
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   340.000  1.090
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   340.000  1.090
   39    40   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    38    75.00000  112.20000
   29    33    39    85.00000  114.68000
   33    37    41    70.00000  124.00000
   33    37    56    70.00000  124.00000
   33    38    62    70.00000  124.00000
   33    38    43    70.00000  119.70000
   33    39    40    55.00000  108.50000
   37    41    42    35.00000  120.00000
   37    41    45    80.00000  120.01400
   37    56    50    70.00000  124.00000
   37    56    61    70.00000  123.01800
   41    45    48    90.00000  111.18400
   45    41    42    55.00000  109.52600
   45    48    49    35.00000  109.50000
   45    48    50    50.00000  109.50000
   45    48    52    50.00000  109.50000
   48    50    51    37.50000  110.70000
   48    50    56    70.00000  112.02700
   48    50    57    58.35000  112.70000
   48    52    53    37.50000  110.70000
   48    52    54    37.50000  110.70000
   48    52    55    37.50000  110.70000
   50    48    49    37.50000  110.70000
   50    56    61    70.00000  124.00000
   50    57    58    37.50000  110.70000
   50    57    59    37.50000  110.70000
   50    57    60    37.50000  110.70000
   56    37    41    70.00000  123.01800
   56    50    51    35.00000  109.50000
   56    61    62    70.00000  117.34000
   56    61    64    70.00000  124.00000
   61    62    63    65.00000  137.10300
   61    62    38    70.00000  123.01800
   61    64    65    35.00000  109.50000
   61    64    66    35.00000  109.50000
   61    64    67    35.00000  109.50000
   62    38    43    60.00000  120.04000
   38    33    37    70.00000  110.12100
   38    62    63    65.00000  137.10300
   38    43    44    80.00000  125.30000
   38    43    46    90.00000  111.55000
   43    46    47    35.00000  113.00000
   46    43    44   100.00000  123.32000
   64    61    62    70.00000  124.00000
   66    64    65    33.00000  107.80000
   67    64    65    33.00000  107.80000
   67    64    66    33.00000  107.80000
   57    50    51    37.50000  110.70000
   57    50    56    70.00000  112.02700
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
   52    48    49    37.50000  110.70000
   52    48    50    58.35000  112.70000
   54    52    53    33.00000  107.80000
   55    52    53    33.00000  107.80000
   55    52    54    33.00000  107.80000
   39    33    37    90.00000  110.39200
   39    33    38    90.00000  110.39200
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    39   0.13850  1.0 1.0
   24    29    33    39  -1.34450 -1.0 2.0
   24    29    33    39   0.57400  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    41   0.42700  1.0 1.0
   29    33    37    41  -0.70350 -1.0 2.0
   29    33    37    41  -0.43150  1.0 3.0
   29    33    37    56   0.42700  1.0 1.0
   29    33    37    56  -0.70350 -1.0 2.0
   29    33    37    56  -0.43150  1.0 3.0
   29    33    38    62   0.42700  1.0 1.0
   29    33    38    62  -0.70350 -1.0 2.0
   29    33    38    62  -0.43150  1.0 3.0
   29    33    38    43   0.09700  1.0 1.0
   29    33    38    43   0.15600 -1.0 2.0
   29    33    38    43  -0.50800  1.0 3.0
   29    33    39    40   0.35600  1.0 1.0
   29    33    39    40  -0.10750 -1.0 2.0
   29    33    39    40  -0.54400  1.0 3.0
   33    37    41    42   7.00000 -1.0 2.0
   33    37    41    45   7.00000 -1.0 2.0
   33    37    56    50   0.35650  1.0 1.0
   33    37    56    50   0.31450 -1.0 2.0
   33    37    56    61  -0.18600  1.0 3.0
   33    38    43    44  -0.64400  1.0 1.0
   33    38    43    44   0.26850 -1.0 2.0
   33    38    43    46  -0.23000  1.0 1.0
   33    38    43    46   0.83800 -1.0 2.0
   33    38    43    46   0.07650  1.0 3.0
   37    33    38    62  -0.28300  1.0 1.0
   37    33    38    62   0.26700 -1.0 2.0
   37    33    38    62  -0.63300  1.0 3.0
   37    33    38    43   0.09700  1.0 1.0
   37    33    38    43   0.15600 -1.0 2.0
   37    33    38    43  -0.50800  1.0 3.0
   37    33    39    40  -0.07800  1.0 1.0
   37    33    39    40  -0.21500 -1.0 2.0
   37    33    39    40  -0.03150  1.0 3.0
   37    41    45    48  -2.26850  1.0 1.0
   37    41    45    48   3.39050 -1.0 2.0
   37    56   -61    62   7.00000 -1.0 2.0
   37    56    61    64   7.00000 -1.0 2.0
   41    37    56    50  -0.18600  1.0 3.0
   41    37    56    61   0.28850  1.0 1.0
   41    37    56    61   2.61350 -1.0 2.0
   41    37    56    61   0.78400  1.0 3.0
   41    45    48    49   0.08050  1.0 3.0
   41    45   -48    50  -0.46850  1.0 1.0
   41    45   -48    50   0.09300 -1.0 2.0
   41    45   -48    50  -0.12850  1.0 3.0
   41    45    48    52  -0.46850  1.0 1.0
   41    45    48    52   0.09300 -1.0 2.0
   41    45    48    52  -0.12850  1.0 3.0
   42    41    45    48   0.50000 -1.0 2.0
   45    48    50    51   0.23400  1.0 3.0
   45    48    50    56   0.61850  1.0 1.0
   45    48    50    56  -0.22750 -1.0 2.0
   45    48    50    56   0.15300  1.0 3.0
   45    48    50    57   0.62750  1.0 1.0
   45    48    50    57  -0.30950 -1.0 2.0
   45    48    50    57   0.27300  1.0 3.0
   45    48    52    53   0.23400  1.0 3.0
   45    48    52    54   0.23400  1.0 3.0
   45    48    52    55   0.23400  1.0 3.0
   48    50   -56    37   0.98200  1.0 1.0
   48    50   -56    37  -0.11900 -1.0 2.0
   48    50   -56    37   0.24250  1.0 3.0
   48    50    56    61   0.09850  1.0 1.0
   48    50    56    61   0.15250 -1.0 2.0
   48    50    56    61  -0.50650  1.0 3.0
   48    50    57    58   0.15000  1.0 3.0
   48    50    57    59   0.15000  1.0 3.0
   48    50    57    60   0.15000  1.0 3.0
   49    48    50    51   0.15000  1.0 3.0
   49    48    50    56   0.15000  1.0 3.0
   49    48    50    57   0.15000  1.0 3.0
   49    48    52    53   0.15000  1.0 3.0
   49    48    52    54   0.15000  1.0 3.0
   49    48    52    55   0.15000  1.0 3.0
   50    48    52    53   0.15000  1.0 3.0
   50    48    52    54   0.15000  1.0 3.0
   50    48    52    55   0.15000  1.0 3.0
   50    56    61    62   7.00000 -1.0 2.0
   50    56    61    64   7.00000 -1.0 2.0
   51    50    56    37   0.00000  1.0 1.0
   51    50    56    61   0.00000  1.0 1.0
   51    50    57    58   0.15000  1.0 3.0
   51    50    57    59   0.15000  1.0 3.0
   51    50    57    60   0.15000  1.0 3.0
   56    37    41    42   7.00000 -1.0 2.0
   56    37   -41    45   7.00000 -1.0 2.0
   56    50    57    58   0.15000  1.0 3.0
   56    50    57    59   0.15000  1.0 3.0
   56    50    57    60   0.15000  1.0 3.0
   56    61    62    63   7.00000 -1.0 2.0
   56    61    62    38   7.00000 -1.0 2.0
   56    61    64    65   0.00000  1.0 1.0
   56    61    64    66   0.00000  1.0 1.0
   56    61    64    67   0.00000  1.0 1.0
   61    62   -38    33   7.00000 -1.0 2.0
   61    62    38    43   7.00000 -1.0 2.0
   62    61    64    65   0.00000  1.0 1.0
   62    61    64    66   0.00000  1.0 1.0
   62    61    64    67   0.00000  1.0 1.0
   62    38    43    44   1.00000 -1.0 2.0
   62    38    43    46  -0.01000  1.0 1.0
   62    38    43    46   1.29850 -1.0 2.0
   62    38    43    46  -0.09550  1.0 3.0
   63    62    38    33   7.00000 -1.0 2.0
   63    62    38    43   7.00000 -1.0 2.0
   38    33    37    41  -0.28300  1.0 1.0
   38    33    37    41   0.26700 -1.0 2.0
   38    33    37    41  -0.63300  1.0 3.0
   38    33   -37    56  -0.28300  1.0 1.0
   38    33   -37    56   0.26700 -1.0 2.0
   38    33   -37    56  -0.63300  1.0 3.0
   38    33    39    40  -0.07800  1.0 1.0
   38    33    39    40  -0.21500 -1.0 2.0
   38    33    39    40  -0.03150  1.0 3.0
   38    43    46    47   1.22000  1.0 1.0
   38    43    46    47   0.17300 -1.0 2.0
   44    43    46    47   0.92200  1.0 1.0
   44    43    46    47   3.74100 -1.0 2.0
   64    61    62    63   7.00000 -1.0 2.0
   64    61    62    38   7.00000 -1.0 2.0
   57    50    56    37   0.98200  1.0 1.0
   57    50    56    37  -0.11900 -1.0 2.0
   57    50    56    37   0.24250  1.0 3.0
   57    50    56    61   0.09850  1.0 1.0
   57    50    56    61   0.15250 -1.0 2.0
   57    50    56    61  -0.50650  1.0 3.0
   52    48    50    51   0.15000  1.0 3.0
   52    48    50    56   0.34400  1.0 1.0
   52    48    50    56   0.09450 -1.0 2.0
   52    48    50    56   0.11100  1.0 3.0
   52    48    50    57   0.56750  1.0 1.0
   52    48    50    57  -0.07550 -1.0 2.0
   52    48    50    57   0.20000  1.0 3.0
   39    33    37    41   0.67800  1.0 1.0
   39    33    37    41   0.47050 -1.0 2.0
   39    33    37    41  -0.62500  1.0 3.0
   39    33    37    56  -0.17300  1.0 1.0
   39    33    37    56   0.35150 -1.0 2.0
   39    33    37    56   0.31550  1.0 3.0
   39    33    38    62   0.67800  1.0 1.0
   39    33    38    62   0.47050 -1.0 2.0
   39    33    38    62  -0.62500  1.0 3.0
   39    33    38    43   0.09700  1.0 1.0
   39    33    38    43   0.15600 -1.0 2.0
   39    33    38    43  -0.50800  1.0 3.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    34    35  10.50000 -1.0 2.0
   33    56    37    41   1.10000 -1.0 2.0
   45    42    41    37   1.10000 -1.0 2.0
   37    50    56    61   1.10000 -1.0 2.0
   62    64    61    56   1.10000 -1.0 2.0
   61    63    62    38   1.10000 -1.0 2.0
   33    43    38    62   1.10000 -1.0 2.0
   38    46    43    44  10.50000 -1.0 2.0
END
