* LIGAND DATABASE FILE (OPLS2005)
*
001      72    74    135    209     395
    1     0 S   NP   _N1_     1    28.67411    94.36972   -20.64251
    2     1 S   H    _HN1     2     1.02781    85.19878   -66.05104
    3     1 S   H    _H1_     3     1.02961    97.30164    41.81164
    4     1 S   H    _H2_     4     1.02840    29.69205   153.72207
    5     1 S   CT   _CA1     5     1.50092   139.09237   175.11396
    6     5 S   HC   _HA1     6     1.09569   105.31107    48.13960
    7     5 S   CO3  _C1_     7     1.53870   112.23171   -72.22938
    8     7 S   O2Z  _O11     8     1.26360   115.04253   -47.52874
    9     7 S   O2Z  _O12     9     1.26234   114.91154   131.70792
   10     5 S   CT   _CB1    10     1.53093   107.44169   166.10537
   11    10 S   HC   HB11    11     1.09815   109.56890   -50.12956
   12    10 S   HC   HB12    12     1.09833   110.33219    66.46312
   13    10 S   CT   _CG1    13     1.53007   112.57797  -171.26030
   14    13 S   HC   HG11    14     1.09529   110.29012   -57.00496
   15    13 S   HC   HG12    15     1.09609   110.25714    62.03857
   16    13 S   C    _CD1    16     1.51789   111.91106  -177.83734
   17    16 S   O    _OE1    17     1.22745   123.04452   -18.41974
   18    16 S   N    _N2_    18     1.38540   111.82809   162.34655
   19    18 S   H    _HN2    19     1.01589   119.06804     1.41416
   20    18 S   CT1  _CA2    20     1.46200   123.48456  -176.89581
   21    20 S   HC   _HA2    21     1.09734   109.32565   -16.81167
   22    20 S   C    _C2_    22     1.53410   108.32516  -132.52399
   23    22 S   O    _O2_    23     1.23003   122.31274  -146.39757
   24    20 S   CT   _CB2    32     1.53542   111.24979   105.29225
   25    24 S   HC   HB21    33     1.09525   109.63941    53.62232
   26    24 S   HC   HB22    34     1.09480   110.24453   172.46516
   27    22 S   N    _N3_    24     1.38531   113.31475    41.09320
   28    27 S   H    _HN3    25     1.01531   118.89765    -0.59215
   29    24 S   S    _SG2    35     1.83085   111.62208   -68.07196
   30    27 S   CT   _CA3    26     1.45447   123.42232   175.05379
   31    30 S   HC   HA31    27     1.09525   109.19770    24.98625
   32    30 S   HC   HA32    28     1.09494   107.12326   141.98977
   33    29 S   CT   _C17    36     1.85652   100.50749   162.80732
   34    30 S   CO3  _C3_    29     1.52933   113.18079   -98.46296
   35    34 S   O2Z  _O31    30     1.26399   115.44529   -43.31027
   36    34 S   O2Z  _O32    31     1.26362   114.96000   137.65417
   37    33 S   CO4  _C16    37     1.53536   106.47245    60.12525
   38    37 S   O    _O34    38     1.22752   122.28974  -109.92742
   39    33 S   OS   _O35    64     1.43236   112.43578   -56.61687
   40    37 S   CA   _C15    39     1.50028   116.90926    70.67621
   41    40 S   CA   _C10    40     1.40751   118.86250    20.99323
   42    41 S   CA   _C11    41     1.39721   120.35285  -178.76046
   43    42 S   HA   _H11    42     1.08692   121.31637  -179.88986
   44    41 S   CO4  _C9_    53     1.48673   121.02198     1.68969
   45    44 S   O    _O33    54     1.22583   120.72921  -173.08664
   46    42 S   CA   _C12    43     1.39098   119.74801    -0.27695
   47    46 S   HA   _H12    44     1.08681   119.86756  -179.80820
   48    33 S   CT   _C8_    55     1.53293   114.57314   176.03405
   49    48 S   HC   _H3_    56     1.10260   108.63114  -169.96434
   50    46 S   CA   _C13    45     1.39600   120.32207     0.37378
   51    50 S   HA   _H13    46     1.08593   117.33944   179.55545
   52    48 S   CT   _C7_    57     1.52378   111.66056    73.70034
   53    52 S   HC   _H9_    58     1.09557   111.42396   -64.02817
   54    52 S   HC   _H10    59     1.09673   110.46648   178.04105
   55    40 S   CA   _C14    47     1.40993   121.28667  -157.50656
   56    52 S   CT   _C6_    60     1.52348   108.26854    58.37509
   57    56 S   HC   _H7_    61     1.09862   107.41963    66.54904
   58    56 S   HC   _H8_    62     1.09662   110.10919  -178.04455
   59    55 S   OS   _O36    48     1.37041   117.33610     0.39067
   60    56 S   CT   _C5_    63     1.53908   112.53168   -53.77051
   61    59 S   CT   _C18    49     1.42189   117.95438   179.13883
   62    61 S   HC   _H14    50     1.09429   107.72147   179.98022
   63    61 S   HC   _H15    51     1.09489   111.14549    62.28955
   64    61 S   HC   _H16    52     1.09490   111.14561   -62.33912
   65    60 S   CT   _C4_    65     1.53530   111.06340   -79.92663
   66    65 S   HC   _H4_    66     1.09524   110.82507   172.91919
   67    65 S   HC   _H5_    67     1.09251   112.39427    52.81649
   68    65 S   HC   _H6_    68     1.09595   111.27618   -66.63392
   69    60 S   CT   _C19    69     1.53839   108.79218   162.19038
   70    69 S   HC   _H17    70     1.09643   110.84623   179.32536
   71    69 S   HC   _H18    71     1.09512   111.85073    58.11271
   72    69 S   HC   _H19    72     1.09635   110.80556   -62.96433
  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
  17   2   1   1  13   5  17  12  12   9   4   9   3   5   3   8
   4   4   2   8   5   4   5  11   4   3   4   8   3   2   1   1
   7   3   2   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    48    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    40    44    48    49    52    60    39  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    40    41    55    44    45    48    49    52    53    54    56    60    39    65    69  
   35    36  
   36  
    0  
   38    40    41    42    50    55    59    44    48    49    52    60    39  
   40    41    55    48    39  
   65    66    67    68    69    70    71    72    40    44    48    49    52    56    57    58    60  
   41    42    43    46    50    51    55    59    61    44    45    48  
   42    43    46    47    50    55    59    44    45    48    49    52  
   43    46    47    50    51    55    44    45    48  
   46    47    50    44  
   45    48    49    52    53    54    56    46    55  
   48    49    52  
   47    50    51    55    59  
   50    51    55  
   49    52    53    54    56    57    58    60  
   52    53    54    56  
   51    55    59    61  
   55    59  
   53    54    56    57    58    60    65    69  
   54    56    57    58    60  
   56    57    58    60  
   59    61    62    63    64  
   57    58    60    65    66    67    68    69    70    71    72  
   58    60    65    69  
   60    65    69  
   61    62    63    64  
   65    66    67    68    69    70    71    72  
   62    63    64  
   63    64  
   64  
    0  
   66    67    68    69    70    71    72  
   67    68    69  
   68    69  
   69  
   70    71    72  
   71    72  
   72  
    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  -0.316400   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   0.396900   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.7500   0.1050   0.537000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   39   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   40   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   41   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   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   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   46   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   47   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   48   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   50   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   51   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   52   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   56   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   60   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   61   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.522
   33    48   268.000  1.529
   33    39   320.000  1.410
   37    38   570.000  1.229
   37    40   310.000  1.470
   40    41   469.000  1.400
   40    55   469.000  1.400
   41    42   469.000  1.400
   41    44   310.000  1.470
   42    43   367.000  1.080
   42    46   469.000  1.400
   46    47   367.000  1.080
   46    50   469.000  1.400
   50    51   367.000  1.080
   50    55   469.000  1.400
   55    59   450.000  1.364
   59    61   320.000  1.410
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
   44    45   570.000  1.229
   44    48   317.000  1.522
   48    49   340.000  1.090
   48    52   268.000  1.529
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    56   268.000  1.529
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    60   268.000  1.529
   60    39   320.000  1.410
   60    65   268.000  1.529
   60    69   268.000  1.529
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   340.000  1.090
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  110.18000
   29    33    48    75.00000  111.63000
   29    33    39    85.00000  114.68000
   33    37    38    80.00000  120.40000
   33    37    40    65.00000  115.47100
   33    48    44    63.00000  111.10000
   33    48    49    37.50000  110.70000
   33    48    52    58.35000  112.70000
   33    39    60    60.00000  109.50000
   37    40    41    60.00000  119.52600
   37    40    55    60.00000  119.52600
   40    37    38    75.00000  123.78400
   40    41    42    63.00000  120.00000
   40    41    44    60.00000  119.52600
   40    55    50    63.00000  120.00000
   40    55    59    70.00000  120.00000
   41    42    43    35.00000  120.00000
   41    42    46    63.00000  120.00000
   41    44    45    75.00000  123.78400
   41    44    48    65.00000  115.47100
   42    46    47    35.00000  120.00000
   42    46    50    63.00000  120.00000
   46    42    43    35.00000  120.00000
   46    50    51    35.00000  120.00000
   46    50    55    63.00000  120.00000
   50    46    47    35.00000  120.00000
   50    55    59    70.00000  120.00000
   55    40    41    63.00000  120.00000
   55    50    51    35.00000  120.00000
   55    59    61    75.00000  111.00000
   59    61    62    35.00000  109.50000
   59    61    63    35.00000  109.50000
   59    61    64    35.00000  109.50000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
   44    41    42    60.00000  119.52600
   44    48    49    35.00000  109.50000
   44    48    52    63.00000  111.10000
   48    33    37    63.00000  111.10000
   48    44    45    80.00000  120.40000
   48    52    53    37.50000  110.70000
   48    52    54    37.50000  110.70000
   48    52    56    58.35000  112.70000
   52    48    49    37.50000  110.70000
   52    56    57    37.50000  110.70000
   52    56    58    37.50000  110.70000
   52    56    60    58.35000  112.70000
   54    52    53    33.00000  107.80000
   56    52    53    37.50000  110.70000
   56    52    54    37.50000  110.70000
   56    60    39    50.00000  109.50000
   56    60    65    58.35000  112.70000
   56    60    69    58.35000  112.70000
   58    56    57    33.00000  107.80000
   60    56    57    37.50000  110.70000
   60    56    58    37.50000  110.70000
   60    65    66    37.50000  110.70000
   60    65    67    37.50000  110.70000
   60    65    68    37.50000  110.70000
   60    69    70    37.50000  110.70000
   60    69    71    37.50000  110.70000
   60    69    72    37.50000  110.70000
   39    33    37    90.00000  108.74100
   39    33    48    50.00000  109.50000
   65    60    39    50.00000  109.50000
   67    65    66    33.00000  107.80000
   68    65    66    33.00000  107.80000
   68    65    67    33.00000  107.80000
   69    60    39    50.00000  109.50000
   69    60    65    58.35000  112.70000
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    48   0.01700  1.0 1.0
   24    29    33    48  -0.23550 -1.0 2.0
   24    29    33    48   0.21350  1.0 3.0
   24    29    33    39   0.13850  1.0 1.0
   24    29    33    39  -1.34450 -1.0 2.0
   24    29    33    39   0.57400  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.30150 -1.0 2.0
   29    33    37    40   0.65300  1.0 1.0
   29    33    37    40  -0.03850 -1.0 2.0
   29    33    37    40   0.33900  1.0 3.0
   29    33    48    44   0.56750  1.0 1.0
   29    33    48    44  -0.07550 -1.0 2.0
   29    33    48    44   0.20000  1.0 3.0
   29    33    48    49   0.15000  1.0 3.0
   29    33    48    52   0.44750  1.0 1.0
   29    33    48    52  -0.17800 -1.0 2.0
   29    33    48    52   0.20200  1.0 3.0
   29    33    39    60   0.14700  1.0 1.0
   29    33    39    60  -1.16150 -1.0 2.0
   29    33    39    60   0.48700  1.0 3.0
   33    37    40    41   2.26350  1.0 1.0
   33    37    40    41   0.76750 -1.0 2.0
   33    37    40    41   0.22500  1.0 3.0
   33    37    40    55   2.26350  1.0 1.0
   33    37    40    55   0.76750 -1.0 2.0
   33    37    40    55   0.22500  1.0 3.0
   33    48    52    53   0.15000  1.0 3.0
   33    48    52    54   0.15000  1.0 3.0
   33    48    52    56   0.56750  1.0 1.0
   33    48    52    56  -0.07550 -1.0 2.0
   33    48    52    56   0.20000  1.0 3.0
   37    33    48    44   0.11950  1.0 1.0
   37    33    48    44   0.20300 -1.0 2.0
   37    33    48    44  -0.70800  1.0 3.0
   37    33    48    49  -0.11250  1.0 3.0
   37    33    48    52  -0.95700  1.0 1.0
   37    33    48    52  -0.18200 -1.0 2.0
   37    33    48    52   0.29450  1.0 3.0
   37    33    39    60  -1.11000  1.0 1.0
   37    33    39    60   0.50250 -1.0 2.0
   37    33    39    60   0.47450  1.0 3.0
   37    40    41    42   3.62500 -1.0 2.0
   37    40   -41    44   3.62500 -1.0 2.0
   37    40    55    50   3.62500 -1.0 2.0
   37    40    55    59   3.62500 -1.0 2.0
   38    37    40    41   1.05000 -1.0 2.0
   38    37    40    55   1.05000 -1.0 2.0
   40    41    42    43   3.62500 -1.0 2.0
   40    41    42    46   3.62500 -1.0 2.0
   40    41    44    45   1.05000 -1.0 2.0
   40    41    44    48   2.26350  1.0 1.0
   40    41    44    48   0.76750 -1.0 2.0
   40    41    44    48   0.22500  1.0 3.0
   40    55    59    61   1.63200 -1.0 2.0
   41    40    55    50   3.62500 -1.0 2.0
   41    40    55    59   3.62500 -1.0 2.0
   41    42    46    47   3.62500 -1.0 2.0
   41    42   -46    50   3.62500 -1.0 2.0
   41    44   -48    33   0.05850 -1.0 2.0
   41    44   -48    33   0.17250  1.0 3.0
   41    44    48    49   0.00000  1.0 1.0
   41    44    48    52   0.05850 -1.0 2.0
   41    44    48    52   0.17250  1.0 3.0
   42    41    44    45   1.05000 -1.0 2.0
   42    41    44    48   2.26350  1.0 1.0
   42    41    44    48   0.76750 -1.0 2.0
   42    41    44    48   0.22500  1.0 3.0
   42    46    50    51   3.62500 -1.0 2.0
   42    46    50    55   3.62500 -1.0 2.0
   43    42    46    47   3.62500 -1.0 2.0
   43    42    46    50   3.62500 -1.0 2.0
   46    50   -55    40   3.62500 -1.0 2.0
   46    50    55    59   3.62500 -1.0 2.0
   47    46    50    51   3.62500 -1.0 2.0
   47    46    50    55   3.62500 -1.0 2.0
   50    55    59    61   1.63200 -1.0 2.0
   51    50    55    40   3.62500 -1.0 2.0
   51    50    55    59   3.62500 -1.0 2.0
   55    40   -41    42   3.62500 -1.0 2.0
   55    40    41    44   3.62500 -1.0 2.0
   55    59    61    62   0.08050  1.0 3.0
   55    59    61    63   0.08050  1.0 3.0
   55    59    61    64   0.08050  1.0 3.0
   44    41    42    43   3.62500 -1.0 2.0
   44    41    42    46   3.62500 -1.0 2.0
   44    48    52    53  -0.11250  1.0 3.0
   44    48    52    54  -0.11250  1.0 3.0
   44    48    52    56  -0.95700  1.0 1.0
   44    48    52    56  -0.18200 -1.0 2.0
   44    48    52    56   0.29450  1.0 3.0
   45    44    48    33   0.30150 -1.0 2.0
   45    44    48    49   0.00000  1.0 1.0
   45    44    48    52   0.30150 -1.0 2.0
   48    33    37    38   0.30150 -1.0 2.0
   48    33   -37    40   0.05850 -1.0 2.0
   48    33   -37    40   0.17250  1.0 3.0
   48    33    39    60   0.06250  1.0 1.0
   48    33    39    60  -0.01100 -1.0 2.0
   48    33    39    60   0.28050  1.0 3.0
   48    52    56    57   0.15000  1.0 3.0
   48    52    56    58   0.15000  1.0 3.0
   48    52   -56    60   0.56750  1.0 1.0
   48    52   -56    60  -0.07550 -1.0 2.0
   48    52   -56    60   0.20000  1.0 3.0
   49    48    52    53   0.15000  1.0 3.0
   49    48    52    54   0.15000  1.0 3.0
   49    48    52    56   0.15000  1.0 3.0
   52    56    60    39   0.62750  1.0 1.0
   52    56    60    39  -0.30950 -1.0 2.0
   52    56    60    39   0.27300  1.0 3.0
   52    56    60    65   0.56750  1.0 1.0
   52    56    60    65  -0.07550 -1.0 2.0
   52    56    60    65   0.20000  1.0 3.0
   52    56    60    69   0.56750  1.0 1.0
   52    56    60    69  -0.07550 -1.0 2.0
   52    56    60    69   0.20000  1.0 3.0
   53    52    56    57   0.15000  1.0 3.0
   53    52    56    58   0.15000  1.0 3.0
   53    52    56    60   0.15000  1.0 3.0
   54    52    56    57   0.15000  1.0 3.0
   54    52    56    58   0.15000  1.0 3.0
   54    52    56    60   0.15000  1.0 3.0
   56    60   -39    33   0.06250  1.0 1.0
   56    60   -39    33  -0.01100 -1.0 2.0
   56    60   -39    33   0.28050  1.0 3.0
   56    60    65    66   0.15000  1.0 3.0
   56    60    65    67   0.15000  1.0 3.0
   56    60    65    68   0.15000  1.0 3.0
   56    60    69    70   0.15000  1.0 3.0
   56    60    69    71   0.15000  1.0 3.0
   56    60    69    72   0.15000  1.0 3.0
   57    56    60    39   0.23400  1.0 3.0
   57    56    60    65   0.15000  1.0 3.0
   57    56    60    69   0.15000  1.0 3.0
   58    56    60    39   0.23400  1.0 3.0
   58    56    60    65   0.15000  1.0 3.0
   58    56    60    69   0.15000  1.0 3.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33    37    40   0.65300  1.0 1.0
   39    33    37    40  -0.03850 -1.0 2.0
   39    33    37    40   0.33900  1.0 3.0
   39    33    48    44  -0.09450  1.0 1.0
   39    33    48    44  -1.12950 -1.0 2.0
   39    33    48    44   0.54000  1.0 3.0
   39    33    48    49   0.23400  1.0 3.0
   39    33   -48    52   0.62750  1.0 1.0
   39    33   -48    52  -0.30950 -1.0 2.0
   39    33   -48    52   0.27300  1.0 3.0
   39    60    65    66   0.23400  1.0 3.0
   39    60    65    67   0.23400  1.0 3.0
   39    60    65    68   0.23400  1.0 3.0
   39    60    69    70   0.23400  1.0 3.0
   39    60    69    71   0.23400  1.0 3.0
   39    60    69    72   0.23400  1.0 3.0
   65    60    39    33   0.06250  1.0 1.0
   65    60    39    33  -0.01100 -1.0 2.0
   65    60    39    33   0.28050  1.0 3.0
   65    60    69    70   0.15000  1.0 3.0
   65    60    69    71   0.15000  1.0 3.0
   65    60    69    72   0.15000  1.0 3.0
   69    60    39    33   0.06250  1.0 1.0
   69    60    39    33  -0.01100 -1.0 2.0
   69    60    39    33   0.28050  1.0 3.0
   69    60    65    66   0.15000  1.0 3.0
   69    60    65    67   0.15000  1.0 3.0
   69    60    65    68   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
   35    30    34    36  10.50000 -1.0 2.0
   33    40    37    38  10.50000 -1.0 2.0
   41    55    40    37   4.00000 -1.0 2.0
   42    44    41    40   4.00000 -1.0 2.0
   46    43    42    41   1.10000 -1.0 2.0
   50    47    46    42   1.10000 -1.0 2.0
   55    51    50    46   1.10000 -1.0 2.0
   50    59    55    40   4.00000 -1.0 2.0
   41    48    44    45  10.50000 -1.0 2.0
END
