* LIGAND DATABASE FILE (OPLS2005)
*
001      74    74    128    192     376
    1     0 S   NP   _N1_     1    28.94516    93.35414   -20.53216
    2     1 S   H    _HN1     2     1.02861    98.97249     8.84158
    3     1 S   H    _H1_     3     1.02968    32.62875   116.98605
    4     1 S   H    _H2_     4     1.02796    81.12857   -98.33429
    5     1 S   CT   _CA1     5     1.50509   139.65428   147.85559
    6     5 S   HC   _HA1     6     1.09681   104.66471    46.31521
    7     5 S   CO3  _C1_     7     1.54434   110.85564   -69.65623
    8     7 S   O2Z  _O11     8     1.26130   116.80762  -118.60984
    9     7 S   O2Z  _O12     9     1.26530   113.79884    60.48851
   10     5 S   CT   _CB1    10     1.53063   107.04154   162.43307
   11    10 S   HC   HB11    11     1.09836   110.03724   -42.33140
   12    10 S   HC   HB12    12     1.09793   110.03502    74.24559
   13    10 S   CT   _CG1    13     1.53126   112.49042  -163.00239
   14    13 S   HC   HG11    14     1.09489   110.84089   -53.58016
   15    13 S   HC   HG12    15     1.09629   110.02054    65.43663
   16    13 S   C    _CD1    16     1.51770   111.83023  -174.47462
   17    16 S   O    _OE1    17     1.22759   123.07971   -11.11142
   18    16 S   N    _N2_    18     1.38605   111.91560   169.09196
   19    18 S   H    _HN2    19     1.01581   119.21336     2.54029
   20    18 S   CT1  _CA2    20     1.46289   123.09906  -175.73116
   21    20 S   HC   _HA2    21     1.09722   109.38114   -11.30664
   22    20 S   C    _C2_    22     1.53336   108.70134  -127.30965
   23    22 S   O    _O2_    23     1.23020   122.14742  -146.80907
   24    20 S   CT   _CB2    32     1.53504   111.19157   110.41558
   25    24 S   HC   HB21    33     1.09379   109.29533    60.38596
   26    24 S   HC   HB22    34     1.09520   110.63033   178.34176
   27    22 S   N    _N3_    24     1.38479   113.42107    40.55803
   28    27 S   H    _HN3    25     1.01527   118.91450    -0.55391
   29    24 S   S    _SG2    35     1.83019   111.49225   -62.14835
   30    27 S   CT   _CA3    26     1.45455   123.47141   175.18472
   31    30 S   HC   HA31    27     1.09521   109.27765    23.58649
   32    30 S   HC   HA32    28     1.09497   107.11102   140.59022
   33    29 S   CT   _C12    36     1.85631   100.49174   148.21141
   34    33 S   HC   _H4_    37     1.09807   105.45352    51.78462
   35    30 S   CO3  _C3_    29     1.52920   113.08424   -99.92389
   36    35 S   O2Z  _O31    30     1.26405   115.38771   -44.95784
   37    35 S   O2Z  _O32    31     1.26352   114.99675   135.97346
   38    33 S   CA   _C13    38     1.52636   110.55892   -66.55997
   39    33 S   CT   _C9_    53     1.55977   110.45855   169.10406
   40    39 S   HC   _H3_    54     1.09346   108.11679    60.16399
   41    38 S   CA   _C14    39     1.40560   119.28079   120.91744
   42    41 S   HA   _H16    40     1.08809   119.87091    -0.63766
   43    39 S   CZ   _C10    55     1.48202   111.40989   -60.18412
   44    39 S   C    _C8_    58     1.53962   110.69176  -179.21541
   45    44 S   O    _O33    59     1.23653   119.71014    36.67544
   46    41 S   CA   _C15    41     1.39784   119.75151   179.47474
   47    43 S   CZ   _C11    56     1.20085   179.67555   175.11894
   48    47 S   HC   _H15    57     1.06501   179.93744  -150.75903
   49    44 S   N    _N4_    60     1.40007   117.96401  -144.89155
   50    46 S   CA   _C16    42     1.39082   121.55576    -0.39217
   51    46 S   NO2  _N5_    50     1.44560   118.11863   179.63846
   52    51 S   ON   _O37    51     1.23808   117.01282    57.05860
   53    51 S   ON   _O36    52     1.23794   117.31056  -121.93541
   54    49 S   CT   _C5_    61     1.46943   125.38248    -4.80387
   55    54 S   HC   _H8_    62     1.09585   108.44439  -143.68654
   56    54 S   HC   _H9_    63     1.09267   110.28180   -27.68502
   57    49 S   CT   _C6_    68     1.46656   118.27705   177.27423
   58    57 S   HC   _H10    69     1.09523   109.08471  -147.82567
   59    57 S   HC   _H11    70     1.09587   109.21451   -31.06254
   60    50 S   CA   _C17    43     1.39170   118.71128     0.40105
   61    50 S   OH   _O35    48     1.36551   121.07289  -178.79277
   62    61 S   HO   _H19    49     0.97464   107.35158   179.69481
   63    54 S   CT   _C4_    64     1.52072   111.94206    94.98276
   64    63 S   HC   _H5_    65     1.09346   111.42955   -59.64415
   65    63 S   HC   _H6_    66     1.09463   111.19502    60.34508
   66    63 S   HC   _H7_    67     1.09431   110.25770  -179.78971
   67    57 S   CT   _C7_    71     1.52078   111.76751    89.69833
   68    67 S   HC   _H12    72     1.09489   111.10329   -59.42390
   69    67 S   HC   _H13    73     1.09461   111.21730    60.52498
   70    67 S   HC   _H14    74     1.09428   110.30686  -179.44362
   71    38 S   CA   _C18    44     1.40762   121.98346   -59.85348
   72    71 S   HA   _H17    45     1.08757   120.09916     0.61070
   73    60 S   OH   _O34    46     1.36743   118.26409   179.96044
   74    73 S   HO   _H18    47     0.97688   109.18053  -175.59460
  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   7   2   1   1  13  11   5  10   4   5  11   3   9   1   1
  14  10   4   1   1  10   6   5   7   5   4   6   3   1   3   2
   1   1   3   2   1   1   3   1   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    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    71    39    40    43    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    46    60    71    72    39    40    43    47    44    45    49  
   38    41    71    39    40    43    44  
   36    37  
   37  
    0  
   41    42    46    50    60    71    72    73    51    39    40    43    44  
   40    43    47    48    44    45    49    54    57    41    71  
   43    47    44    45    49  
   42    46    50    60    71    72    61    51    52    53  
   46    50    71    51  
   47    48    44    45    49  
   45    49    54    55    56    63    57    58    59    67    47  
   49    54    57  
   50    60    71    73    61    62    51    52    53  
   48  
    0  
   54    55    56    63    64    65    66    57    58    59    67    68    69    70  
   60    71    72    73    74    61    62    51    52    53  
   52    53    60    61  
   53  
    0  
   55    56    63    64    65    66    57    58    59    67  
   56    63    64    65    66    57  
   63    64    65    66    57  
   58    59    67    68    69    70    63  
   59    67    68    69    70  
   67    68    69    70  
   71    72    73    74    61    62  
   62    71    73  
    0  
   64    65    66  
   65    66  
   66  
    0  
   68    69    70  
   69    70  
   70  
    0  
   72    73    74  
   73  
   74  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.222500   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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   43   3.6500   0.1500   0.010000   2.0580   1.8250   0.025318638  -1.264311570
   44   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   46   3.5500   0.0700   0.090000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.6500   0.1500  -0.210000   2.0580   1.8250   0.025318638  -1.264311570
   48   2.4200   0.0300   0.200000   1.3810   1.2100   0.008598240   0.268726247
   49   3.2500   0.1700  -0.140000   1.8100   1.6000   0.054801302  -1.445846770
   50   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   51   3.2500   0.1700   0.650000   1.8650   1.6500   0.020864068  -0.347800883
   52   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   53   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   54   3.5000   0.0660  -0.050000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   57   3.5000   0.0660  -0.050000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   60   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   61   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   62   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   63   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   72   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   73   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   74   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
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   317.000  1.510
   33    39   268.000  1.529
   38    41   469.000  1.400
   38    71   469.000  1.400
   41    42   367.000  1.080
   41    46   469.000  1.400
   46    50   469.000  1.400
   46    51   400.000  1.460
   50    60   469.000  1.400
   50    61   450.000  1.364
   60    71   469.000  1.400
   60    73   450.000  1.364
   71    72   367.000  1.080
   73    74   553.000  0.945
   61    62   553.000  0.945
   51    52   550.000  1.225
   51    53   550.000  1.225
   39    40   340.000  1.090
   39    43   390.000  1.470
   39    44   317.000  1.522
   43    47   985.000  1.221
   47    48   410.000  1.067
   44    45   570.000  1.229
   44    49   490.000  1.335
   49    54   337.000  1.449
   49    57   337.000  1.449
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    63   268.000  1.529
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   340.000  1.090
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    67   268.000  1.529
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   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    80.00000  109.48900
   29    33    39    75.00000  111.63000
   33    38    41    70.00000  120.00000
   33    38    71    70.00000  120.00000
   33    39    40    37.50000  110.70000
   33    39    43    58.35000  112.70000
   33    39    44    63.00000  111.10000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    46    63.00000  120.00000
   38    71    60    63.00000  120.00000
   38    71    72    35.00000  120.00000
   41    46    50    63.00000  120.00000
   41    46    51    85.00000  120.00000
   46    41    42    35.00000  120.00000
   46    50    60    63.00000  120.00000
   46    50    61    70.00000  120.00000
   46    51    52    80.00000  117.50000
   46    51    53    80.00000  117.50000
   50    60    71    63.00000  120.00000
   50    60    73    70.00000  120.00000
   50    61    62    35.00000  113.00000
   60    71    72    35.00000  120.00000
   60    73    74    35.00000  113.00000
   71    38    41    63.00000  120.00000
   73    60    71    70.00000  120.00000
   61    50    60    70.00000  120.00000
   51    46    50    85.00000  120.00000
   53    51    52    80.00000  125.30000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.17500
   39    43    47    30.00000  179.48800
   39    44    45    80.00000  120.40000
   39    44    49    70.00000  116.60000
   43    39    40    35.00000  108.50000
   43    47    48    20.00000  179.85100
   44    39    40    35.00000  109.50000
   44    39    43    70.00000  111.78000
   44    49    54    50.00000  121.90000
   44    49    57    50.00000  121.90000
   49    44    45    80.00000  122.90000
   49    54    55    35.00000  109.50000
   49    54    56    35.00000  109.50000
   49    54    63    70.00000  110.72300
   49    57    58    35.00000  109.50000
   49    57    59    35.00000  109.50000
   49    57    67    70.00000  110.72300
   54    63    64    37.50000  110.70000
   54    63    65    37.50000  110.70000
   54    63    66    37.50000  110.70000
   56    54    55    33.00000  107.80000
   63    54    55    37.50000  110.70000
   63    54    56    37.50000  110.70000
   65    63    64    33.00000  107.80000
   66    63    64    33.00000  107.80000
   66    63    65    33.00000  107.80000
   57    49    54    50.00000  118.00000
   57    67    68    37.50000  110.70000
   57    67    69    37.50000  110.70000
   57    67    70    37.50000  110.70000
   59    57    58    33.00000  107.80000
   67    57    58    37.50000  110.70000
   67    57    59    37.50000  110.70000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    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  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    38    71  -0.16000  1.0 1.0
   29    33    38    71  -0.03200 -1.0 2.0
   29    33    38    71   0.04500  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    43   0.56750  1.0 1.0
   29    33    39    43  -0.07550 -1.0 2.0
   29    33    39    43   0.20000  1.0 3.0
   29    33    39    44   0.56750  1.0 1.0
   29    33    39    44  -0.07550 -1.0 2.0
   29    33    39    44   0.20000  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    46   3.62500 -1.0 2.0
   33    38    71    60   3.62500 -1.0 2.0
   33    38    71    72   3.62500 -1.0 2.0
   33    39    43    47   0.00000  1.0 1.0
   33    39    44    45   0.30150 -1.0 2.0
   33    39    44    49   1.39750  1.0 1.0
   33    39    44    49  -0.07950 -1.0 2.0
   33    39    44    49  -0.18750  1.0 3.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    71   0.00000  1.0 1.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    43   0.15000  1.0 3.0
   34    33    39    44  -0.11250  1.0 3.0
   38    33    39    40   0.43200  1.0 3.0
   38    33    39    43   0.56750  1.0 1.0
   38    33    39    43  -0.07550 -1.0 2.0
   38    33    39    43   0.20000  1.0 3.0
   38    33    39    44   0.56750  1.0 1.0
   38    33    39    44  -0.07550 -1.0 2.0
   38    33    39    44   0.20000  1.0 3.0
   38    41    46    50   3.62500 -1.0 2.0
   38    41    46    51   3.62500 -1.0 2.0
   41    38    71    60   3.62500 -1.0 2.0
   41    38    71    72   3.62500 -1.0 2.0
   41    46   -50    60   3.62500 -1.0 2.0
   41    46    50    61   3.62500 -1.0 2.0
   41    46    51    52   0.69950 -1.0 2.0
   41    46    51    53   0.69950 -1.0 2.0
   42    41    46    50   3.62500 -1.0 2.0
   42    41    46    51   3.62500 -1.0 2.0
   46    50    60    71   3.62500 -1.0 2.0
   46    50    60    73   3.62500 -1.0 2.0
   46    50    61    62   0.84100 -1.0 2.0
   50    46    51    52   0.69950 -1.0 2.0
   50    46    51    53   0.69950 -1.0 2.0
   50    60   -71    38   3.62500 -1.0 2.0
   50    60    71    72   3.62500 -1.0 2.0
   50    60    73    74   0.84100 -1.0 2.0
   60    50    61    62   0.84100 -1.0 2.0
   71    38    41    42   3.62500 -1.0 2.0
   71    38   -41    46   3.62500 -1.0 2.0
   71    60    73    74   0.84100 -1.0 2.0
   73    60    71    38   3.62500 -1.0 2.0
   73    60    71    72   3.62500 -1.0 2.0
   61    50    60    71   3.62500 -1.0 2.0
   61    50    60    73   3.62500 -1.0 2.0
   51    46    50    60   3.62500 -1.0 2.0
   51    46    50    61   3.62500 -1.0 2.0
   39    33    38    41   0.04150 -1.0 2.0
   39    33    38    71   0.04150 -1.0 2.0
   39    43    47    48   0.00000  1.0 1.0
   39    44    49    54   1.49850  1.0 1.0
   39    44    49    54   1.53950 -1.0 2.0
   39    44    49    57   1.49850  1.0 1.0
   39    44    49    57   1.53950 -1.0 2.0
   40    39    43    47   0.00000  1.0 1.0
   40    39    44    45   0.00000  1.0 1.0
   40    39    44    49   0.00000  1.0 1.0
   43    39    44    45   0.30150 -1.0 2.0
   43    39    44    49   0.00000  1.0 1.0
   44    39    43    47   0.00000  1.0 1.0
   44    49    54    55   0.00000  1.0 1.0
   44    49    54    56   0.00000  1.0 1.0
   44    49    54    63  -0.43950  1.0 1.0
   44    49    54    63  -0.08100 -1.0 2.0
   44    49    54    63   0.03350  1.0 3.0
   44    49    57    58   0.00000  1.0 1.0
   44    49    57    59   0.00000  1.0 1.0
   44    49    57    67  -0.43950  1.0 1.0
   44    49    57    67  -0.08100 -1.0 2.0
   44    49    57    67   0.03350  1.0 3.0
   45    44    49    54   3.04450 -1.0 2.0
   45    44    49    57   3.04450 -1.0 2.0
   49    54    63    64   0.15000  1.0 3.0
   49    54    63    65   0.15000  1.0 3.0
   49    54    63    66   0.15000  1.0 3.0
   49    57    67    68   0.15000  1.0 3.0
   49    57    67    69   0.15000  1.0 3.0
   49    57    67    70   0.15000  1.0 3.0
   54    49    57    58   0.00000  1.0 1.0
   54    49    57    59   0.00000  1.0 1.0
   54    49    57    67  -0.05900 -1.0 2.0
   55    54    63    64   0.15000  1.0 3.0
   55    54    63    65   0.15000  1.0 3.0
   55    54    63    66   0.15000  1.0 3.0
   56    54    63    64   0.15000  1.0 3.0
   56    54    63    65   0.15000  1.0 3.0
   56    54    63    66   0.15000  1.0 3.0
   57    49    54    55   0.00000  1.0 1.0
   57    49    54    56   0.00000  1.0 1.0
   57    49    54    63  -0.05900 -1.0 2.0
   58    57    67    68   0.15000  1.0 3.0
   58    57    67    69   0.15000  1.0 3.0
   58    57    67    70   0.15000  1.0 3.0
   59    57    67    68   0.15000  1.0 3.0
   59    57    67    69   0.15000  1.0 3.0
   59    57    67    70   0.15000  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   41    71    38    33   4.00000 -1.0 2.0
   46    42    41    38   1.10000 -1.0 2.0
   50    51    46    41   4.00000 -1.0 2.0
   60    61    50    46   4.00000 -1.0 2.0
   71    73    60    50   4.00000 -1.0 2.0
   60    72    71    38   1.10000 -1.0 2.0
   52    46    51    53  10.50000 -1.0 2.0
   39    49    44    45  10.50000 -1.0 2.0
   57    44    49    54   1.00000 -1.0 2.0
END
