* LIGAND DATABASE FILE (OPLS2005)
*
001      74    74    128    184     368
    1     0 S   NP   _N1_     1    28.63260    97.08197   -23.07797
    2     1 S   H    _HN1     2     1.02828    43.38548   167.89489
    3     1 S   H    _H1_     3     1.02785   102.38467   -89.07289
    4     1 S   H    _H2_     4     1.02950    68.25659    15.97342
    5     1 S   CT   _CA1     5     1.50107   143.12624   111.35989
    6     5 S   HC   _HA1     6     1.09573   105.20610    97.02714
    7     5 S   CO3  _C1_     7     1.53791   112.45535   -23.22786
    8     7 S   O2Z  _O11     8     1.26371   115.00896   -42.88238
    9     7 S   O2Z  _O12     9     1.26239   114.94726   136.28267
   10     5 S   CT   _CB1    10     1.53083   107.42434  -144.98461
   11    10 S   HC   HB11    11     1.09831   109.38994   -49.79031
   12    10 S   HC   HB12    12     1.09813   110.44040    66.82126
   13    10 S   CT   _CG1    13     1.52986   112.59435  -170.77282
   14    13 S   HC   HG11    14     1.09583   110.61516   -65.17060
   15    13 S   HC   HG12    15     1.09669   109.80313    54.05699
   16    13 S   C    _CD1    16     1.51797   112.25375   174.51913
   17    16 S   O    _OE1    17     1.22728   123.29898     6.01783
   18    16 S   N    _N2_    18     1.38651   111.65113  -174.08798
   19    18 S   H    _HN2    19     1.01580   118.94245     1.79362
   20    18 S   CT1  _CA2    20     1.46199   123.39842   177.72119
   21    20 S   HC   _HA2    21     1.09736   109.37010     2.01635
   22    20 S   C    _C2_    22     1.53539   108.57455  -113.46237
   23    22 S   O    _O2_    23     1.23052   122.30432  -147.79033
   24    20 S   CT   _CB2    32     1.53322   111.58853   124.02964
   25    24 S   HC   HB21    33     1.09589   110.09479    56.20395
   26    24 S   HC   HB22    34     1.09467   109.96658   175.29797
   27    22 S   N    _N3_    24     1.38338   113.68096    39.65024
   28    27 S   H    _HN3    25     1.01587   119.58536    -3.32655
   29    24 S   S    _SG2    35     1.82856   111.49277   -64.72642
   30    27 S   CT   _CA3    26     1.45287   123.20469   177.12213
   31    30 S   HC   HA31    27     1.09549   107.51015   -64.56234
   32    30 S   HC   HA32    28     1.09556   107.98479    51.87561
   33    29 S   CT   _C12    36     1.83986    99.64447   173.20139
   34    33 S   HC   _H3_    37     1.09724   106.10643   -51.87982
   35    30 S   CO3  _C3_    29     1.52959   114.08121   173.86963
   36    35 S   O2Z  _O31    30     1.26376   116.06540    -0.74808
   37    35 S   O2Z  _O32    31     1.26428   114.41373   179.31472
   38    33 S   CA   _C7_    38     1.51948   112.05277    67.45914
   39    33 S   CT   _C13    58     1.53620   108.64120  -167.47432
   40    39 S   HC   _H14    59     1.09734   111.48250    54.13651
   41    39 S   HC   _H15    60     1.09711   111.76732   -65.15711
   42    38 S   CA   _C6_    39     1.40283   119.32946  -117.84854
   43    42 S   HA   _H8_    40     1.08741   120.34354     0.53339
   44    39 S   CO4  _C14    61     1.51166   110.65702   172.49747
   45    44 S   O    _O36    62     1.22440   123.69656   -57.63814
   46    42 S   CA   _C5_    41     1.39446   120.30661  -178.83467
   47    44 S   OS   _O37    63     1.36071   109.89993   121.55231
   48    46 S   CA   _C10    42     1.39327   120.21048    -1.86561
   49    46 S   OS   _O33    53     1.37041   118.55228  -179.02241
   50    47 S   CT   _C15    64     1.44661   117.76990  -176.83789
   51    50 S   HC   _H4_    65     1.09854   109.02214   -34.15414
   52    48 S   CA   _C9_    43     1.39853   120.58245     2.27176
   53    48 S   OH   _O34    51     1.37008   119.03723  -177.92302
   54    53 S   HO   _H10    52     0.97373   107.12037  -175.68203
   55    49 S   CT   _C4_    54     1.42868   109.91515   -96.22414
   56    55 S   HC   _H5_    55     1.09410   107.76511   175.85868
   57    55 S   HC   _H6_    56     1.09582   111.35889    57.60464
   58    55 S   HC   _H7_    57     1.09497   111.24683   -65.99068
   59    50 S   CO3  _C18    66     1.54177   108.26556  -147.70064
   60    59 S   O2Z  _O41    67     1.26583   115.30734    35.50649
   61    59 S   O2Z  _O40    68     1.26408   115.85732  -147.23107
   62    50 S   CT   _C16    69     1.52656   109.76062    84.74934
   63    62 S   HC   _H16    70     1.09755   109.03064  -174.19677
   64    62 S   HC   _H17    71     1.09752   109.01818   -57.82331
   65    38 S   CA   _C8_    44     1.40863   121.81751    62.92332
   66    65 S   HA   _H9_    45     1.08610   118.43698    -0.49968
   67    52 S   OS   _O35    46     1.37113   115.56644   179.26725
   68    62 S   CO3  _C17    72     1.53431   118.28445    62.92044
   69    68 S   O2Z  _O39    73     1.26632   113.90735   171.87747
   70    68 S   O2Z  _O38    74     1.26068   116.99639    -8.99888
   71    67 S   CT   _C11    47     1.42266   116.76855  -172.17677
   72    71 S   HC   _H11    48     1.09427   107.72378   175.27026
   73    71 S   HC   _H12    49     1.09503   111.38735    57.41724
   74    71 S   HC   _H13    50     1.09484   110.96008   -67.13471
  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
  14   7   2   1   1  13   8   4   3   9   4   6   2  11   9   9
   6  10   7   9   3   1   3   2   1   1   6   2   1   5   4   3
   3   1   4   2   1   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    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    42    65    39    40    41    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    42    43    46    52    65    66    39    40    41    44    45    47  
   38    42    65    39    40    41    44  
   36    37  
   37  
    0  
   42    43    46    48    52    65    66    67    49    39    40    41    44  
   40    41    44    45    47    50    42    65  
   41    44    45    47  
   44    45    47  
   43    46    48    52    65    66    53    49    55  
   46    48    65    49  
   45    47    50    51    59    62  
   47    50  
   48    52    65    67    53    54    49    55    56    57    58  
   50    51    59    60    61    62    63    64    68  
   52    65    66    67    71    53    54    49    55  
   55    56    57    58    52    53  
   51    59    60    61    62    63    64    68    69    70  
   59    60    61    62    63    64    68  
   65    66    67    71    72    73    74    53    54  
   54    65    67  
    0  
   56    57    58  
   57    58  
   58  
    0  
   60    61    62    63    64    68  
   61    62  
   62  
   63    64    68    69    70  
   64    68    69    70  
   68    69    70  
   66    67    71  
   67  
   71    72    73    74  
   69    70  
   70  
    0  
   72    73    74  
   73    74  
   74  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.222500   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   42   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   43   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   44   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   46   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   48   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   50   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   52   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   53   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   54   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   55   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   59   3.7500   0.1050   0.600000   2.1120   1.8750   0.001000000  -0.126889456
   60   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   61   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   62   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   65   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   67   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   68   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   69   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   70   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   71   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.030000   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   317.000  1.510
   33    39   268.000  1.529
   38    42   469.000  1.400
   38    65   469.000  1.400
   42    43   367.000  1.080
   42    46   469.000  1.400
   46    48   469.000  1.400
   46    49   450.000  1.364
   48    52   469.000  1.400
   48    53   450.000  1.364
   52    65   469.000  1.400
   52    67   450.000  1.364
   65    66   367.000  1.080
   67    71   320.000  1.410
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   340.000  1.090
   53    54   553.000  0.945
   49    55   320.000  1.410
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    44   317.000  1.522
   44    45   570.000  1.229
   44    47   214.000  1.327
   47    50   320.000  1.410
   50    51   340.000  1.090
   50    59   317.000  1.522
   50    62   268.000  1.529
   59    60   656.000  1.250
   59    61   656.000  1.250
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    68   317.000  1.522
   68    69   656.000  1.250
   68    70   656.000  1.250
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    42    70.00000  120.00000
   33    38    65    70.00000  120.00000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    44    63.00000  111.10000
   38    33    34    35.00000  109.50000
   38    42    43    35.00000  120.00000
   38    42    46    63.00000  120.00000
   38    65    52    63.00000  120.00000
   38    65    66    35.00000  120.00000
   42    46    48    63.00000  120.00000
   42    46    49    70.00000  120.00000
   46    42    43    35.00000  120.00000
   46    48    52    63.00000  120.00000
   46    48    53    70.00000  120.00000
   46    49    55    75.00000  111.00000
   48    52    65    63.00000  120.00000
   48    52    67    70.00000  120.00000
   48    53    54    35.00000  113.00000
   52    65    66    35.00000  120.00000
   52    67    71    75.00000  111.00000
   65    38    42    63.00000  120.00000
   67    52    65    70.00000  120.00000
   67    71    72    35.00000  109.50000
   67    71    73    35.00000  109.50000
   67    71    74    35.00000  109.50000
   73    71    72    33.00000  107.80000
   74    71    72    33.00000  107.80000
   74    71    73    33.00000  107.80000
   53    48    52    70.00000  120.00000
   49    46    48    70.00000  120.00000
   49    55    56    35.00000  109.50000
   49    55    57    35.00000  109.50000
   49    55    58    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
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.17500
   39    44    45    80.00000  120.40000
   39    44    47    81.00000  111.40000
   41    39    40    33.00000  107.80000
   44    39    40    35.00000  109.50000
   44    39    41    35.00000  109.50000
   44    47    50    83.00000  116.90000
   47    44    45    83.00000  123.40000
   47    50    51    35.00000  109.50000
   47    50    59    85.00000  109.63000
   47    50    62    50.00000  109.50000
   50    59    60    70.00000  117.00000
   50    59    61    70.00000  117.00000
   50    62    63    37.50000  110.70000
   50    62    64    37.50000  110.70000
   50    62    68    70.00000  109.69300
   59    50    51    35.00000  109.50000
   61    59    60    80.00000  126.00000
   62    50    51    37.50000  110.70000
   62    50    59    70.00000  109.69300
   62    68    69    70.00000  117.00000
   62    68    70    70.00000  117.00000
   64    62    63    33.00000  107.80000
   68    62    63    35.00000  109.50000
   68    62    64    35.00000  109.50000
   70    68    69    80.00000  126.00000
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    42  -0.16000  1.0 1.0
   29    33    38    42  -0.03200 -1.0 2.0
   29    33    38    42   0.04500  1.0 3.0
   29    33    38    65  -0.16000  1.0 1.0
   29    33    38    65  -0.03200 -1.0 2.0
   29    33    38    65   0.04500  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  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    42    43   3.62500 -1.0 2.0
   33    38    42    46   3.62500 -1.0 2.0
   33    38    65    52   3.62500 -1.0 2.0
   33    38    65    66   3.62500 -1.0 2.0
   33    39    44    45   0.30150 -1.0 2.0
   33    39    44    47   0.36750  1.0 3.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    38    65   0.00000  1.0 1.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   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    41   0.43200  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    42    46    48   3.62500 -1.0 2.0
   38    42    46    49   3.62500 -1.0 2.0
   42    38    65    52   3.62500 -1.0 2.0
   42    38    65    66   3.62500 -1.0 2.0
   42    46   -48    52   3.62500 -1.0 2.0
   42    46    48    53   3.62500 -1.0 2.0
   42    46    49    55   1.63200 -1.0 2.0
   43    42    46    48   3.62500 -1.0 2.0
   43    42    46    49   3.62500 -1.0 2.0
   46    48    52    65   3.62500 -1.0 2.0
   46    48    52    67   3.62500 -1.0 2.0
   46    48    53    54   0.84100 -1.0 2.0
   46    49    55    56   0.08050  1.0 3.0
   46    49    55    57   0.08050  1.0 3.0
   46    49    55    58   0.08050  1.0 3.0
   48    46    49    55   1.63200 -1.0 2.0
   48    52   -65    38   3.62500 -1.0 2.0
   48    52    65    66   3.62500 -1.0 2.0
   48    52    67    71   1.63200 -1.0 2.0
   52    48    53    54   0.84100 -1.0 2.0
   52    67    71    72   0.08050  1.0 3.0
   52    67    71    73   0.08050  1.0 3.0
   52    67    71    74   0.08050  1.0 3.0
   65    38    42    43   3.62500 -1.0 2.0
   65    38   -42    46   3.62500 -1.0 2.0
   65    52    67    71   1.63200 -1.0 2.0
   67    52    65    38   3.62500 -1.0 2.0
   67    52    65    66   3.62500 -1.0 2.0
   53    48    52    65   3.62500 -1.0 2.0
   53    48    52    67   3.62500 -1.0 2.0
   49    46    48    52   3.62500 -1.0 2.0
   49    46    48    53   3.62500 -1.0 2.0
   39    33    38    42   0.04150 -1.0 2.0
   39    33    38    65   0.04150 -1.0 2.0
   39    44    47    50   1.63150  1.0 1.0
   39    44    47    50   2.92000 -1.0 2.0
   40    39    44    45   0.00000  1.0 1.0
   40    39    44    47   0.00000  1.0 1.0
   41    39    44    45   0.00000  1.0 1.0
   41    39    44    47   0.00000  1.0 1.0
   44    47    50    51   0.08050  1.0 3.0
   44    47    50    59  -1.80650  1.0 1.0
   44    47    50    59   0.63900 -1.0 2.0
   44    47    50    59   0.03650  1.0 3.0
   44    47    50    62  -0.25900  1.0 1.0
   44    47    50    62  -0.47000 -1.0 2.0
   44    47    50    62   0.11750  1.0 3.0
   45    44    47    50   3.00000 -1.0 2.0
   47    50    59    60   0.30150 -1.0 2.0
   47    50    59    61   0.30150 -1.0 2.0
   47    50    62    63   0.23400  1.0 3.0
   47    50    62    64   0.23400  1.0 3.0
   47    50    62    68  -3.35100  1.0 1.0
   47    50    62    68  -0.37050 -1.0 2.0
   47    50    62    68   0.22400  1.0 3.0
   50    62    68    69   0.41150 -1.0 2.0
   50    62    68    70   0.41150 -1.0 2.0
   51    50    59    60   0.00000  1.0 1.0
   51    50    59    61   0.00000  1.0 1.0
   51    50    62    63   0.15000  1.0 3.0
   51    50    62    64   0.15000  1.0 3.0
   51    50    62    68  -0.11250  1.0 3.0
   59    50    62    63  -0.11250  1.0 3.0
   59    50    62    64  -0.11250  1.0 3.0
   59    50    62    68  -0.30950  1.0 1.0
   59    50    62    68   1.11150 -1.0 2.0
   59    50    62    68   0.40350  1.0 3.0
   62    50    59    60   0.41150 -1.0 2.0
   62    50    59    61   0.41150 -1.0 2.0
   63    62    68    69   0.00000  1.0 1.0
   63    62    68    70   0.00000  1.0 1.0
   64    62    68    69   0.00000  1.0 1.0
   64    62    68    70   0.00000  1.0 1.0
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
   42    65    38    33   4.00000 -1.0 2.0
   46    43    42    38   1.10000 -1.0 2.0
   48    49    46    42   4.00000 -1.0 2.0
   52    53    48    46   4.00000 -1.0 2.0
   65    67    52    48   4.00000 -1.0 2.0
   52    66    65    38   1.10000 -1.0 2.0
   39    47    44    45  10.50000 -1.0 2.0
   60    50    59    61  10.50000 -1.0 2.0
   69    62    68    70  10.50000 -1.0 2.0
END
