* LIGAND DATABASE FILE (OPLS2005)
*
001      75    75    137    199     400
    1     0 S   NP   _N1_     1    28.64533    93.77522   -22.98639
    2     1 S   H    _HN1     2     1.02778    95.43302  -114.42413
    3     1 S   H    _H1_     3     1.02956    94.09702    -5.55354
    4     1 S   H    _H2_     4     1.02839    22.68515   120.71183
    5     1 S   CT   _CA1     5     1.50113   133.40408   117.76530
    6     5 S   HC   _HA1     6     1.09572   105.25005    60.45620
    7     5 S   CO3  _C1_     7     1.53804   112.29838   -59.82551
    8     7 S   O2Z  _O11     8     1.26367   115.00451   -45.62223
    9     7 S   O2Z  _O12     9     1.26230   114.92412   133.49929
   10     5 S   CT   _CB1    10     1.53085   107.43958   178.40971
   11    10 S   HC   HB11    11     1.09825   109.43994   -50.16906
   12    10 S   HC   HB12    12     1.09825   110.40430    66.41706
   13    10 S   CT   _CG1    13     1.53010   112.61988  -171.22354
   14    13 S   HC   HG11    14     1.09601   110.45986   -62.26722
   15    13 S   HC   HG12    15     1.09639   110.02218    56.99986
   16    13 S   C    _CD1    16     1.51762   112.20625   177.43196
   17    16 S   O    _OE1    17     1.22754   123.27469    -2.29542
   18    16 S   N    _N2_    18     1.38531   111.74782   177.30543
   19    18 S   H    _HN2    19     1.01568   119.17060     5.49465
   20    18 S   CT1  _CA2    20     1.45704   122.80904  -179.94405
   21    20 S   HC   _HA2    21     1.09476   108.66505    21.02833
   22    20 S   C    _C2_    22     1.52903   107.04094   -95.45891
   23    22 S   O    _O2_    23     1.22991   122.96730   -26.27733
   24    20 S   CT   _CB2    32     1.53287   112.48836   144.34822
   25    24 S   HC   HB21    33     1.09671   109.53997    66.07866
   26    24 S   HC   HB22    34     1.09495   110.85874  -177.02540
   27    22 S   N    _N3_    24     1.38466   112.69875   156.27674
   28    27 S   H    _HN3    25     1.01638   120.48021    -0.96225
   29    24 S   S    _SG2    35     1.83116   114.32510   -52.83584
   30    27 S   CT   _CA3    26     1.45362   122.33337   179.11067
   31    30 S   HC   HA31    27     1.09568   107.47789   -62.57312
   32    30 S   HC   HA32    28     1.09568   107.91179    53.72104
   33    29 S   CT   _C13    36     1.86648   100.99626   -70.01293
   34    33 S   HC   _H3_    37     1.08631   105.34692    30.10371
   35    30 S   CO3  _C3_    29     1.52856   114.45291   175.63193
   36    35 S   O2Z  _O31    30     1.26301   116.09279    -3.97271
   37    35 S   O2Z  _O32    31     1.26447   114.38821   176.09635
   38    33 S   CT   _C11    38     1.55468   105.36515   -85.97402
   39    38 S   HC   _H24    39     1.09970   109.09731    46.98520
   40    38 S   HC   _H25    40     1.09443   109.30201   -66.05166
   41    33 S   CT   _C14    56     1.57069   110.97022   147.43903
   42    38 S   CM   _C6_    41     1.51413   117.38809   166.09396
   43    41 S   CT   _C18    57     1.54263   113.29290   -46.83669
   44    43 S   HC   _H38    58     1.09488   112.20357    70.04748
   45    43 S   HC   _H39    59     1.09371   111.85870   -52.75466
   46    43 S   HC   _H40    60     1.09695   110.61575  -173.23618
   47    41 S   OH   _O17    61     1.44117   106.87353    70.73391
   48    47 S   HO   _H41    62     0.97250   108.22764  -173.06540
   49    42 S   CO4  _C7_    42     1.49730   113.98853   -61.32331
   50    49 S   O    _O16    43     1.22992   119.50181   -63.98923
   51    42 S   CM   _C8_    67     1.35340   127.02315   123.60874
   52    49 S   CT   _C10    44     1.52330   117.93867   112.45969
   53    52 S   HC   _H22    45     1.09631   108.32088   135.93330
   54    52 S   HC   _H23    46     1.09369   110.40677    20.94426
   55    51 S   CT   _C16    68     1.50915   123.57193    -6.64393
   56    55 S   HC   _H32    69     1.09469   110.12589   106.35380
   57    55 S   HC   _H33    70     1.09596   109.99034  -134.41607
   58    55 S   HC   _H34    71     1.09141   113.81935   -15.60789
   59    51 S   CT   _C17    72     1.51152   124.34188   172.77083
   60    59 S   HC   _H35    73     1.09490   110.05880   110.29117
   61    59 S   HC   _H36    74     1.09577   109.97262  -130.45837
   62    59 S   HC   _H37    75     1.09277   113.77701   -11.23547
   63    52 S   CM   _C5_    47     1.50467   109.87139  -102.79382
   64    63 S   CM   _C4_    48     1.34729   124.24495   102.87885
   65    64 S   HC   _H19    49     1.08997   117.64236   179.69417
   66    63 S   CT   _C15    63     1.50759   115.73322   -78.21125
   67    66 S   HC   _H29    64     1.09487   110.22378   -57.26476
   68    66 S   HC   _H30    65     1.09529   112.33399  -177.08154
   69    66 S   HC   _H31    66     1.09284   110.77898    62.88638
   70    64 S   CT   _C9_    50     1.50023   128.54802     2.42366
   71    70 S   HC   _H20    51     1.09820   108.14732    61.34060
   72    70 S   HC   _H21    52     1.09834   107.07622   173.17458
   73    70 S   CT   _C12    53     1.53642   119.96947   -63.52493
   74    73 S   HC   _H26    54     1.08905   109.92009    77.17387
   75    73 S   HC   _H27    55     1.10129   105.73964  -173.36883
  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
  18   8   2   1   1  13   5   4  14  15   9   4   3   2   5   1
  10   5   9  10   4   3   7   3   2   1   3   2   1   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    41    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    42    73    41    43    47  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    42    49    70    73    74    75    41    43    44    45    46    47    48    51  
   38    39    40    42    73    41    43    47  
   36    37  
   37  
    0  
   39    40    42    49    50    52    73    41    43    47    51    55    59  
   40    42    49    41    51  
   42    49    41    51  
   43    44    45    46    47    48    42    64    70    71    72    73    74    75  
   49    50    52    53    54    63    51    55    56    57    58    59    60    61    62  
   44    45    46    47    48    70    73    74    75  
   45    46    47    73  
   46    47    73  
   47    73  
   48    70    73    74    75  
   73  
   50    52    53    54    63    64    66    51    55    59  
   52    53    54    63    51  
   55    56    57    58    59    60    61    62    52  
   53    54    63    64    65    70    66    67    68    69  
   54    63    64    66  
   63    64    66  
   56    57    58    59    60    61    62  
   57    58    59  
   58    59  
   59  
   60    61    62  
   61    62  
   62  
    0  
   64    65    70    71    72    73    66    67    68    69  
   65    70    71    72    73    74    75    66    67    68    69  
   70    71    72    73    66  
   67    68    69    70  
   68    69  
   69  
    0  
   71    72    73    74    75  
   72    73    74    75  
   73    74    75  
   74    75  
   75  
    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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   42   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   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   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   50   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   51   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   52   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   54   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   55   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   64   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   65   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   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    41   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    42   317.000  1.510
   42    49   320.000  1.462
   42    51   549.000  1.340
   49    50   570.000  1.229
   49    52   317.000  1.522
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    63   317.000  1.510
   63    64   549.000  1.340
   63    66   317.000  1.510
   64    65   340.000  1.080
   64    70   317.000  1.510
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   268.000  1.529
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    41   268.000  1.529
   41    43   268.000  1.529
   41    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
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   340.000  1.090
   51    55   317.000  1.510
   51    59   317.000  1.510
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   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    41    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    42    70.00000  112.02700
   33    41    73    58.35000  112.70000
   33    41    43    58.35000  112.70000
   33    41    47    50.00000  109.50000
   38    33    34    37.50000  110.70000
   38    42    49    65.00000  116.34900
   38    42    51    70.00000  124.00000
   40    38    39    33.00000  107.80000
   42    38    39    35.00000  109.50000
   42    38    40    35.00000  109.50000
   42    49    50    80.00000  123.72100
   42    49    52    65.00000  118.62400
   42    51    55    70.00000  124.00000
   42    51    59    70.00000  124.00000
   49    52    53    35.00000  109.50000
   49    52    54    35.00000  109.50000
   49    52    63    70.00000  109.06800
   52    49    50    80.00000  120.40000
   52    63    64    70.00000  124.00000
   52    63    66    65.00000  117.92700
   54    52    53    33.00000  107.80000
   63    52    53    35.00000  109.50000
   63    52    54    35.00000  109.50000
   63    64    65    35.00000  120.00000
   63    64    70    70.00000  124.00000
   63    66    67    35.00000  109.50000
   63    66    68    35.00000  109.50000
   63    66    69    35.00000  109.50000
   64    70    71    35.00000  109.50000
   64    70    72    35.00000  109.50000
   64    70    73    70.00000  112.02700
   70    64    65    35.00000  117.00000
   70    73    74    37.50000  110.70000
   70    73    75    37.50000  110.70000
   70    73    41    58.35000  112.70000
   72    70    71    33.00000  107.80000
   73    70    71    37.50000  110.70000
   73    70    72    37.50000  110.70000
   73    41    43    58.35000  112.70000
   73    41    47    50.00000  109.50000
   75    73    74    33.00000  107.80000
   41    33    34    37.50000  110.70000
   41    33    38    58.35000  112.70000
   41    73    74    37.50000  110.70000
   41    73    75    37.50000  110.70000
   41    43    44    37.50000  110.70000
   41    43    45    37.50000  110.70000
   41    43    46    37.50000  110.70000
   41    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    41    43    50.00000  109.50000
   66    63    64    70.00000  124.00000
   68    66    67    33.00000  107.80000
   69    66    67    33.00000  107.80000
   69    66    68    33.00000  107.80000
   51    42    49    65.00000  118.96000
   51    55    56    35.00000  109.50000
   51    55    57    35.00000  109.50000
   51    55    58    35.00000  109.50000
   51    59    60    35.00000  109.50000
   51    59    61    35.00000  109.50000
   51    59    62    35.00000  109.50000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   59    51    55    65.00000  117.92700
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    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    41   0.01700  1.0 1.0
   24    29    33    41  -0.23550 -1.0 2.0
   24    29    33    41   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    42   0.56750  1.0 1.0
   29    33    38    42  -0.07550 -1.0 2.0
   29    33    38    42   0.20000  1.0 3.0
   29    33    41    73   0.44750  1.0 1.0
   29    33    41    73  -0.17800 -1.0 2.0
   29    33    41    73   0.20200  1.0 3.0
   29    33    41    43   0.44750  1.0 1.0
   29    33    41    43  -0.17800 -1.0 2.0
   29    33    41    43   0.20200  1.0 3.0
   29    33    41    47   0.56750  1.0 1.0
   29    33    41    47  -0.07550 -1.0 2.0
   29    33    41    47   0.20000  1.0 3.0
   33    38    42    49   0.09700  1.0 1.0
   33    38    42    49   0.15600 -1.0 2.0
   33    38    42    49  -0.50800  1.0 3.0
   33    38    42    51   0.09850  1.0 1.0
   33    38    42    51   0.15250 -1.0 2.0
   33    38    42    51  -0.50650  1.0 3.0
   33    41    43    44   0.15000  1.0 3.0
   33    41    43    45   0.15000  1.0 3.0
   33    41    43    46   0.15000  1.0 3.0
   33    41    47    48  -0.11600  1.0 1.0
   33    41    47    48  -0.09450 -1.0 2.0
   33    41    47    48   0.21250  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    42   0.15000  1.0 3.0
   34    33    41    73   0.15000  1.0 3.0
   34    33    41    43   0.15000  1.0 3.0
   34    33    41    47   0.23400  1.0 3.0
   38    33    41    73   0.56750  1.0 1.0
   38    33    41    73  -0.07550 -1.0 2.0
   38    33    41    73   0.20000  1.0 3.0
   38    33    41    43   0.56750  1.0 1.0
   38    33    41    43  -0.07550 -1.0 2.0
   38    33    41    43   0.20000  1.0 3.0
   38    33    41    47   0.86500  1.0 1.0
   38    33    41    47  -0.17500 -1.0 2.0
   38    33    41    47   0.20800  1.0 3.0
   38    42    49    50  -0.64400  1.0 1.0
   38    42    49    50   0.26850 -1.0 2.0
   38    42    49    52   0.25700  1.0 1.0
   38    42    49    52   0.66200 -1.0 2.0
   38    42    49    52   0.04450  1.0 3.0
   38    42    51    55   7.00000 -1.0 2.0
   38    42    51    59   7.00000 -1.0 2.0
   39    38    42    49   0.15000  1.0 3.0
   39    38    42    51   0.00000  1.0 1.0
   40    38    42    49   0.15000  1.0 3.0
   40    38    42    51   0.00000  1.0 1.0
   42    49    52    53   0.00000  1.0 1.0
   42    49    52    54   0.00000  1.0 1.0
   42    49    52    63   0.65300  1.0 1.0
   42    49    52    63  -0.03850 -1.0 2.0
   42    49    52    63   0.33900  1.0 3.0
   42    51    55    56   0.00000  1.0 1.0
   42    51    55    57   0.00000  1.0 1.0
   42    51    55    58   0.00000  1.0 1.0
   42    51    59    60   0.00000  1.0 1.0
   42    51    59    61   0.00000  1.0 1.0
   42    51    59    62   0.00000  1.0 1.0
   49    42    51    55   7.00000 -1.0 2.0
   49    42    51    59   7.00000 -1.0 2.0
   49    52    63    64  -0.51250  1.0 1.0
   49    52    63    64  -0.88800 -1.0 2.0
   49    52    63    64   0.08850  1.0 3.0
   49    52    63    66   0.17250  1.0 1.0
   49    52    63    66  -0.04100 -1.0 2.0
   49    52    63    66  -0.33850  1.0 3.0
   50    49    52    53   0.00000  1.0 1.0
   50    49    52    54   0.00000  1.0 1.0
   50    49    52    63   0.30150 -1.0 2.0
   52    63    64    65   7.00000 -1.0 2.0
   52    63    64    70   7.00000 -1.0 2.0
   52    63    66    67   0.34800  1.0 3.0
   52    63    66    68   0.34800  1.0 3.0
   52    63    66    69   0.34800  1.0 3.0
   53    52    63    64   0.00000  1.0 1.0
   53    52    63    66   0.34800  1.0 3.0
   54    52    63    64   0.00000  1.0 1.0
   54    52    63    66   0.34800  1.0 3.0
   63    64    70    71   0.00000  1.0 1.0
   63    64    70    72   0.00000  1.0 1.0
   63    64    70    73   0.09850  1.0 1.0
   63    64    70    73   0.15250 -1.0 2.0
   63    64    70    73  -0.50650  1.0 3.0
   64    63    66    67   0.00000  1.0 1.0
   64    63    66    68   0.00000  1.0 1.0
   64    63    66    69   0.00000  1.0 1.0
   64    70    73    74   0.15000  1.0 3.0
   64    70    73    75   0.15000  1.0 3.0
   64    70    73    41   0.34400  1.0 1.0
   64    70    73    41   0.09450 -1.0 2.0
   64    70    73    41   0.11100  1.0 3.0
   65    64    70    71   0.33100  1.0 3.0
   65    64    70    72   0.33100  1.0 3.0
   65    64    70    73   0.00000  1.0 1.0
   70    73    41    33   0.56750  1.0 1.0
   70    73    41    33  -0.07550 -1.0 2.0
   70    73    41    33   0.20000  1.0 3.0
   70    73    41    43   0.56750  1.0 1.0
   70    73    41    43  -0.07550 -1.0 2.0
   70    73    41    43   0.20000  1.0 3.0
   70    73    41    47   0.86500  1.0 1.0
   70    73    41    47  -0.17500 -1.0 2.0
   70    73    41    47   0.20800  1.0 3.0
   71    70    73    74   0.15000  1.0 3.0
   71    70    73    75   0.15000  1.0 3.0
   71    70    73    41   0.15000  1.0 3.0
   72    70    73    74   0.15000  1.0 3.0
   72    70    73    75   0.15000  1.0 3.0
   72    70    73    41   0.15000  1.0 3.0
   73    41    43    44   0.15000  1.0 3.0
   73    41    43    45   0.15000  1.0 3.0
   73    41    43    46   0.15000  1.0 3.0
   73    41    47    48  -0.11600  1.0 1.0
   73    41    47    48  -0.09450 -1.0 2.0
   73    41    47    48   0.21250  1.0 3.0
   74    73    41    33   0.15000  1.0 3.0
   74    73    41    43   0.15000  1.0 3.0
   74    73    41    47   0.23400  1.0 3.0
   75    73    41    33   0.15000  1.0 3.0
   75    73    41    43   0.15000  1.0 3.0
   75    73    41    47   0.23400  1.0 3.0
   41    33    38    39   0.15000  1.0 3.0
   41    33    38    40   0.15000  1.0 3.0
   41    33    38    42   0.34400  1.0 1.0
   41    33    38    42   0.09450 -1.0 2.0
   41    33    38    42   0.11100  1.0 3.0
   43    41    47    48  -0.11600  1.0 1.0
   43    41    47    48  -0.09450 -1.0 2.0
   43    41    47    48   0.21250  1.0 3.0
   47    41    43    44   0.23400  1.0 3.0
   47    41    43    45   0.23400  1.0 3.0
   47    41    43    46   0.23400  1.0 3.0
   66    63    64    65   7.00000 -1.0 2.0
   66    63    64    70   7.00000 -1.0 2.0
   51    42    49    50   1.00000 -1.0 2.0
   51    42    49    52  -0.33500  1.0 1.0
   51    42    49    52   1.06600 -1.0 2.0
   51    42    49    52  -0.14000  1.0 3.0
   55    51    59    60   0.34800  1.0 3.0
   55    51    59    61   0.34800  1.0 3.0
   55    51    59    62   0.34800  1.0 3.0
   59    51    55    56   0.34800  1.0 3.0
   59    51    55    57   0.34800  1.0 3.0
   59    51    55    58   0.34800  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
   37    30    35    36  10.50000 -1.0 2.0
   38    49    42    51   1.10000 -1.0 2.0
   42    52    49    50  10.50000 -1.0 2.0
   52    66    63    64   1.10000 -1.0 2.0
   70    65    64    63   1.10000 -1.0 2.0
   55    59    51    42   1.10000 -1.0 2.0
END
