* LIGAND DATABASE FILE (OPLS2005)
*
001      64    65    121    191     362
    1     0 S   NP   _N1_     1    28.87820    93.86549   -20.15685
    2     1 S   H    _HN1     2     1.02971   100.08053    49.50908
    3     1 S   H    _H1_     3     1.02832    25.26633   158.08754
    4     1 S   H    _H2_     4     1.02774    87.89634   -58.76121
    5     1 S   CT   _CA1     5     1.50138   134.48559  -178.49676
    6     5 S   HC   _HA1     6     1.09579   105.22037    48.58995
    7     5 S   CO3  _C1_     7     1.53818   112.49218   -71.47910
    8     7 S   O2Z  _O11     8     1.26336   115.03352   -40.19993
    9     7 S   O2Z  _O12     9     1.26259   114.94028   139.04238
   10     5 S   CT   _CB1    10     1.53109   107.38519   166.43694
   11    10 S   HC   HB11    11     1.09810   109.24357   -51.24222
   12    10 S   HC   HB12    12     1.09829   110.38914    65.24939
   13    10 S   CT   _CG1    13     1.52987   112.74922  -172.53371
   14    13 S   HC   HG11    14     1.09562   110.16034   -62.63701
   15    13 S   HC   HG12    15     1.09627   110.25640    56.42377
   16    13 S   C    _CD1    16     1.51819   112.21036   176.38486
   17    16 S   O    _OE1    17     1.22728   123.12618   -18.13222
   18    16 S   N    _N2_    18     1.38574   111.72790   163.11978
   19    18 S   H    _HN2    19     1.01589   118.96459     0.76745
   20    18 S   CT1  _CA2    20     1.46270   123.58522  -178.66866
   21    20 S   HC   _HA2    21     1.09737   109.34681   -19.46605
   22    20 S   C    _C2_    22     1.53431   107.92583  -135.07306
   23    22 S   O    _O2_    23     1.22992   122.38324  -144.30618
   24    20 S   CT   _CB2    32     1.53609   111.24682   102.98315
   25    24 S   HC   HB21    33     1.09338   109.17139    51.70573
   26    24 S   HC   HB22    34     1.09489   110.31811   170.31085
   27    22 S   N    _N3_    24     1.38550   113.22022    42.95710
   28    27 S   H    _HN3    25     1.01540   118.92439    -0.40494
   29    24 S   S    _SG2    35     1.82865   111.38579   -71.04066
   30    27 S   CT   _CA3    26     1.45449   123.40394   175.13522
   31    30 S   HC   HA31    27     1.09526   109.18257    25.29841
   32    30 S   HC   HA32    28     1.09493   107.13078   142.30275
   33    29 S   CT   _C10    36     1.85219   103.31225   156.09241
   34    30 S   CO3  _C3_    29     1.52934   113.17080   -98.13633
   35    34 S   O2Z  _O31    30     1.26398   115.43604   -43.49980
   36    34 S   O2Z  _O32    31     1.26358   114.95806   137.43802
   37    33 S   CT   _C5_    37     1.55664   106.41879   169.80482
   38    37 S   HC   _H16    38     1.09832   110.87635   -46.50506
   39    37 S   HC   _H17    39     1.09698   110.05135  -162.00144
   40    33 S   CT   _C7_    51     1.54020   113.55625    46.37850
   41    40 S   HC   _H20    52     1.09561   111.92391   -45.87158
   42    37 S   CT   _C6_    40     1.52987   114.15485    77.13958
   43    42 S   HC   _H18    41     1.09782   109.33175   177.72273
   44    42 S   HC   _H19    42     1.09724   110.44910   -67.44884
   45    40 S   CT   _C12    53     1.52114   116.68950    80.15039
   46    45 S   HC   _H23    54     1.09452   112.46268    66.00844
   47    45 S   HC   _H24    55     1.09415   111.24535   -56.22902
   48    45 S   HC   _H25    56     1.09596   110.05088  -175.49881
   49    42 S   CT   _C11    43     1.53438   112.16430    55.60851
   50    49 S   CT   _C9_    44     1.54267   110.32636   -55.56050
   51    50 S   HC   _H22    45     1.09711   108.83418   174.00390
   52    49 S   CT   _C13    59     1.53490   111.84095    70.03798
   53    52 S   HC   _H26    60     1.09626   110.48427   177.57683
   54    52 S   HC   _H27    61     1.09653   110.55686    60.45331
   55    52 S   HC   _H28    62     1.09145   113.60125   -60.72545
   56    49 S   OH   _O14    63     1.43558   108.31396  -173.64532
   57    56 S   HO   _H30    64     0.97227   108.09214   -55.77848
   58    33 S   CT   _C8_    46     1.53652   113.55812   -67.37338
   59    58 S   HC   _H21    47     1.09659   111.37045    46.04199
   60    50 S   OH   _O13    57     1.43365   108.70531   -70.24988
   61    60 S   HO   _H29    58     0.97218   107.48847  -166.40224
   62    58 S   OS   _O34    48     1.43872   103.85263   159.34216
   63    62 S   CO4  _C4_    49     1.37111   109.67305   -25.42673
   64    63 S   O    _O33    50     1.22071   124.22359  -177.04038
  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  13   5   4   3
  21   2   1   1  16   7   6  12   8  13   5   4   7   3   2   1
  13  13   7   7   3   2   1   3   1   6   3   2   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    58    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    42    50    58    59    62    63    40    41    45  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    42    43    44    49    50    51    58    59    62    63    64    40    41    45    46    47    48    60  
   35    36  
   36  
    0  
   38    39    42    43    44    49    50    58    59    62    63    40    41    45    52    56  
   39    42    43    44    49    58    40  
   42    43    44    49    58    40  
   41    45    46    47    48    42    50    58    59    62    63    64  
   45    46    47    48    58    62    63    64  
   43    44    49    50    51    58    60    52    53    54    55    56    57  
   44    49    50    52    56  
   49    50    52    56  
   46    47    48    58    62    63    64  
   47    48    63  
   48    63  
   63  
   50    51    58    59    62    60    61    52    53    54    55    56    57  
   51    58    59    62    63    60    61    52    53    54    55    56    57  
   58    59    62    60    61    52    56  
   53    54    55    56    57    58    60  
   54    55    56  
   55    56  
   56  
   57    58    60  
    0  
   59    62    63    64    60    61  
   62    63    60  
   61    62  
    0  
   63    64  
   64  
    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   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   42   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   50   3.5000   0.0660   0.205000   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   57   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   58   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   60   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   61   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   62   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   63   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   64   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   268.000  1.529
   33    58   268.000  1.529
   33    40   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    42   268.000  1.529
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    49   268.000  1.529
   49    50   268.000  1.529
   49    52   268.000  1.529
   49    56   320.000  1.410
   50    51   340.000  1.090
   50    58   268.000  1.529
   50    60   320.000  1.410
   58    59   340.000  1.090
   58    62   320.000  1.410
   62    63   214.000  1.327
   63    64   570.000  1.229
   63    40   317.000  1.522
   40    41   340.000  1.090
   40    45   268.000  1.529
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   340.000  1.090
   60    61   553.000  0.945
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   340.000  1.090
   56    57   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  111.63000
   29    33    58    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    42    58.35000  112.70000
   33    58    50    58.35000  112.70000
   33    58    59    37.50000  110.70000
   33    58    62    50.00000  109.50000
   33    40    63    63.00000  111.10000
   33    40    41    37.50000  110.70000
   33    40    45    58.35000  112.70000
   37    42    43    37.50000  110.70000
   37    42    44    37.50000  110.70000
   37    42    49    58.35000  112.70000
   39    37    38    33.00000  107.80000
   42    37    38    37.50000  110.70000
   42    37    39    37.50000  110.70000
   42    49    50    58.35000  112.70000
   42    49    52    58.35000  112.70000
   42    49    56    50.00000  109.50000
   44    42    43    33.00000  107.80000
   49    42    43    37.50000  110.70000
   49    42    44    37.50000  110.70000
   49    50    51    37.50000  110.70000
   49    50    58    58.35000  112.70000
   49    50    60    50.00000  109.50000
   49    52    53    37.50000  110.70000
   49    52    54    37.50000  110.70000
   49    52    55    37.50000  110.70000
   49    56    57    55.00000  108.50000
   50    58    59    37.50000  110.70000
   50    58    62    50.00000  109.50000
   50    60    61    55.00000  108.50000
   58    33    37    58.35000  112.70000
   58    50    51    37.50000  110.70000
   58    62    63    83.00000  116.90000
   62    58    59    35.00000  109.50000
   62    63    64    83.00000  123.40000
   62    63    40    81.00000  111.40000
   63    40    41    35.00000  109.50000
   63    40    45    63.00000  111.10000
   40    33    37    58.35000  112.70000
   40    33    58    58.35000  112.70000
   40    63    64    80.00000  120.40000
   40    45    46    37.50000  110.70000
   40    45    47    37.50000  110.70000
   40    45    48    37.50000  110.70000
   45    40    41    37.50000  110.70000
   47    45    46    33.00000  107.80000
   48    45    46    33.00000  107.80000
   48    45    47    33.00000  107.80000
   60    50    51    35.00000  109.50000
   60    50    58    50.00000  109.50000
   52    49    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
   56    49    50    50.00000  109.50000
   56    49    52    50.00000  109.50000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    58   0.01700  1.0 1.0
   24    29    33    58  -0.23550 -1.0 2.0
   24    29    33    58   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    37    38   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    42   0.44750  1.0 1.0
   29    33    37    42  -0.17800 -1.0 2.0
   29    33    37    42   0.20200  1.0 3.0
   29    33    58    50   0.44750  1.0 1.0
   29    33    58    50  -0.17800 -1.0 2.0
   29    33    58    50   0.20200  1.0 3.0
   29    33    58    59   0.15000  1.0 3.0
   29    33    58    62   0.56750  1.0 1.0
   29    33    58    62  -0.07550 -1.0 2.0
   29    33    58    62   0.20000  1.0 3.0
   29    33    40    63   0.56750  1.0 1.0
   29    33    40    63  -0.07550 -1.0 2.0
   29    33    40    63   0.20000  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    45   0.44750  1.0 1.0
   29    33    40    45  -0.17800 -1.0 2.0
   29    33    40    45   0.20200  1.0 3.0
   33    37    42    43   0.15000  1.0 3.0
   33    37    42    44   0.15000  1.0 3.0
   33    37    42    49   0.56750  1.0 1.0
   33    37    42    49  -0.07550 -1.0 2.0
   33    37    42    49   0.20000  1.0 3.0
   33    58   -62    63  -0.25900  1.0 1.0
   33    58   -62    63  -0.47000 -1.0 2.0
   33    58   -62    63   0.11750  1.0 3.0
   33    40    45    46   0.15000  1.0 3.0
   33    40    45    47   0.15000  1.0 3.0
   33    40    45    48   0.15000  1.0 3.0
   37    33    58    50   0.56750  1.0 1.0
   37    33    58    50  -0.07550 -1.0 2.0
   37    33    58    50   0.20000  1.0 3.0
   37    33    58    59   0.15000  1.0 3.0
   37    33    58    62   0.62750  1.0 1.0
   37    33    58    62  -0.30950 -1.0 2.0
   37    33    58    62   0.27300  1.0 3.0
   37    33    40    63  -0.95700  1.0 1.0
   37    33    40    63  -0.18200 -1.0 2.0
   37    33    40    63   0.29450  1.0 3.0
   37    33    40    41   0.15000  1.0 3.0
   37    33    40    45   0.56750  1.0 1.0
   37    33    40    45  -0.07550 -1.0 2.0
   37    33    40    45   0.20000  1.0 3.0
   37    42   -49    50   0.56750  1.0 1.0
   37    42   -49    50  -0.07550 -1.0 2.0
   37    42   -49    50   0.20000  1.0 3.0
   37    42    49    52   0.56750  1.0 1.0
   37    42    49    52  -0.07550 -1.0 2.0
   37    42    49    52   0.20000  1.0 3.0
   37    42    49    56   0.86500  1.0 1.0
   37    42    49    56  -0.17500 -1.0 2.0
   37    42    49    56   0.20800  1.0 3.0
   38    37    42    43   0.15000  1.0 3.0
   38    37    42    44   0.15000  1.0 3.0
   38    37    42    49   0.15000  1.0 3.0
   39    37    42    43   0.15000  1.0 3.0
   39    37    42    44   0.15000  1.0 3.0
   39    37    42    49   0.15000  1.0 3.0
   42    49    50    51   0.15000  1.0 3.0
   42    49    50    58   0.56750  1.0 1.0
   42    49    50    58  -0.07550 -1.0 2.0
   42    49    50    58   0.20000  1.0 3.0
   42    49    50    60   0.86500  1.0 1.0
   42    49    50    60  -0.17500 -1.0 2.0
   42    49    50    60   0.20800  1.0 3.0
   42    49    52    53   0.15000  1.0 3.0
   42    49    52    54   0.15000  1.0 3.0
   42    49    52    55   0.15000  1.0 3.0
   42    49    56    57  -0.11600  1.0 1.0
   42    49    56    57  -0.09450 -1.0 2.0
   42    49    56    57   0.21250  1.0 3.0
   43    42    49    50   0.15000  1.0 3.0
   43    42    49    52   0.15000  1.0 3.0
   43    42    49    56   0.23400  1.0 3.0
   44    42    49    50   0.15000  1.0 3.0
   44    42    49    52   0.15000  1.0 3.0
   44    42    49    56   0.23400  1.0 3.0
   49    50   -58    33   0.56750  1.0 1.0
   49    50   -58    33  -0.07550 -1.0 2.0
   49    50   -58    33   0.20000  1.0 3.0
   49    50    58    59   0.15000  1.0 3.0
   49    50    58    62   0.62750  1.0 1.0
   49    50    58    62  -0.30950 -1.0 2.0
   49    50    58    62   0.27300  1.0 3.0
   49    50    60    61  -0.11600  1.0 1.0
   49    50    60    61  -0.09450 -1.0 2.0
   49    50    60    61   0.21250  1.0 3.0
   50    49    52    53   0.15000  1.0 3.0
   50    49    52    54   0.15000  1.0 3.0
   50    49    52    55   0.15000  1.0 3.0
   50    49    56    57  -0.11600  1.0 1.0
   50    49    56    57  -0.09450 -1.0 2.0
   50    49    56    57   0.21250  1.0 3.0
   50    58    62    63  -0.25900  1.0 1.0
   50    58    62    63  -0.47000 -1.0 2.0
   50    58    62    63   0.11750  1.0 3.0
   51    50    58    33   0.15000  1.0 3.0
   51    50    58    59   0.15000  1.0 3.0
   51    50    58    62   0.23400  1.0 3.0
   51    50    60    61   0.19450  1.0 3.0
   58    33    37    38   0.15000  1.0 3.0
   58    33    37    39   0.15000  1.0 3.0
   58    33   -37    42   0.56750  1.0 1.0
   58    33   -37    42  -0.07550 -1.0 2.0
   58    33   -37    42   0.20000  1.0 3.0
   58    33   -40    63  -0.95700  1.0 1.0
   58    33   -40    63  -0.18200 -1.0 2.0
   58    33   -40    63   0.29450  1.0 3.0
   58    33    40    41   0.15000  1.0 3.0
   58    33    40    45   0.56750  1.0 1.0
   58    33    40    45  -0.07550 -1.0 2.0
   58    33    40    45   0.20000  1.0 3.0
   58    50    60    61  -0.11600  1.0 1.0
   58    50    60    61  -0.09450 -1.0 2.0
   58    50    60    61   0.21250  1.0 3.0
   58    62    63    64   3.00000 -1.0 2.0
   58    62   -63    40   1.63150  1.0 1.0
   58    62   -63    40   2.92000 -1.0 2.0
   59    58    62    63   0.08050  1.0 3.0
   62    63   -40    33   0.36750  1.0 3.0
   62    63    40    41   0.00000  1.0 1.0
   62    63    40    45   0.36750  1.0 3.0
   63    40    45    46  -0.11250  1.0 3.0
   63    40    45    47  -0.11250  1.0 3.0
   63    40    45    48  -0.11250  1.0 3.0
   64    63    40    33   0.30150 -1.0 2.0
   64    63    40    41   0.00000  1.0 1.0
   64    63    40    45   0.30150 -1.0 2.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    42   0.56750  1.0 1.0
   40    33    37    42  -0.07550 -1.0 2.0
   40    33    37    42   0.20000  1.0 3.0
   40    33    58    50   0.56750  1.0 1.0
   40    33    58    50  -0.07550 -1.0 2.0
   40    33    58    50   0.20000  1.0 3.0
   40    33    58    59   0.15000  1.0 3.0
   40    33   -58    62   0.62750  1.0 1.0
   40    33   -58    62  -0.30950 -1.0 2.0
   40    33   -58    62   0.27300  1.0 3.0
   41    40    45    46   0.15000  1.0 3.0
   41    40    45    47   0.15000  1.0 3.0
   41    40    45    48   0.15000  1.0 3.0
   60    50    58    33   0.86500  1.0 1.0
   60    50    58    33  -0.17500 -1.0 2.0
   60    50    58    33   0.20800  1.0 3.0
   60    50    58    59   0.23400  1.0 3.0
   60    50    58    62   3.69350  1.0 1.0
   60    50    58    62  -1.82950 -1.0 2.0
   52    49    50    51   0.15000  1.0 3.0
   52    49    50    58   0.56750  1.0 1.0
   52    49    50    58  -0.07550 -1.0 2.0
   52    49    50    58   0.20000  1.0 3.0
   52    49    50    60   0.86500  1.0 1.0
   52    49    50    60  -0.17500 -1.0 2.0
   52    49    50    60   0.20800  1.0 3.0
   52    49    56    57  -0.11600  1.0 1.0
   52    49    56    57  -0.09450 -1.0 2.0
   52    49    56    57   0.21250  1.0 3.0
   56    49    50    51   0.23400  1.0 3.0
   56    49    50    58   0.86500  1.0 1.0
   56    49    50    58  -0.17500 -1.0 2.0
   56    49    50    58   0.20800  1.0 3.0
   56    49    50    60   3.75450  1.0 1.0
   56    49    52    53   0.23400  1.0 3.0
   56    49    52    54   0.23400  1.0 3.0
   56    49    52    55   0.23400  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
   62    40    63    64  10.50000 -1.0 2.0
END
