* LIGAND DATABASE FILE (OPLS2005)
*
001      66    67    114    179     335
    1     0 S   NP   _N1_     1    28.75460    95.39507   -24.21002
    2     1 S   H    _HN1     2     1.02947    77.78987    11.17475
    3     1 S   H    _H1_     3     1.02827    30.67372   174.03274
    4     1 S   H    _H2_     4     1.02788   109.82962   -94.15450
    5     1 S   CT   _CA1     5     1.50121   131.24061   117.73910
    6     5 S   HC   _HA1     6     1.09571   105.19929    86.36764
    7     5 S   CO3  _C1_     7     1.53810   112.29132   -33.89867
    8     7 S   O2Z  _O11     8     1.26381   115.01146   -45.45861
    9     7 S   O2Z  _O12     9     1.26223   114.96621   133.48731
   10     5 S   CT   _CB1    10     1.53068   107.39111  -155.64749
   11    10 S   HC   HB11    11     1.09836   109.47609   -48.86959
   12    10 S   HC   HB12    12     1.09809   110.45753    67.77514
   13    10 S   CT   _CG1    13     1.52977   112.53765  -169.75642
   14    13 S   HC   HG11    14     1.09584   110.69766   -64.33430
   15    13 S   HC   HG12    15     1.09663   109.72236    54.87937
   16    13 S   C    _CD1    16     1.51823   112.12734   175.35734
   17    16 S   O    _OE1    17     1.22747   123.24858     7.96982
   18    16 S   N    _N2_    18     1.38540   111.68963  -172.28449
   19    18 S   H    _HN2    19     1.01781   118.84272     2.34552
   20    18 S   CT1  _CA2    20     1.46209   123.59213   178.18738
   21    20 S   HC   _HA2    21     1.09731   109.32251     2.37174
   22    20 S   C    _C2_    22     1.53573   108.89627  -113.12925
   23    22 S   O    _O2_    23     1.23077   122.22510  -151.06610
   24    20 S   CT   _CB2    32     1.53302   111.31663   124.35541
   25    24 S   HC   HB21    33     1.09432   109.39959    55.56405
   26    24 S   HC   HB22    34     1.09501   110.67268   174.40224
   27    22 S   N    _N3_    24     1.38348   113.82617    36.78681
   28    27 S   H    _HN3    25     1.01577   119.51392    -4.90876
   29    24 S   S    _SG2    35     1.83053   111.32022   -66.03252
   30    27 S   CT   _CA3    26     1.45262   123.15170   176.99776
   31    30 S   HC   HA31    27     1.09556   107.73958   -58.36322
   32    30 S   HC   HA32    28     1.09558   107.70789    58.01710
   33    29 S   CT   _C10    36     1.84473    99.68860   169.99142
   34    33 S   HC   _H3_    37     1.09620   105.35028    48.52236
   35    30 S   CO3  _C3_    29     1.52942   114.17802   179.78239
   36    35 S   O2Z  _O31    30     1.26367   116.12874    -1.33838
   37    35 S   O2Z  _O32    31     1.26447   114.40293   178.62200
   38    33 S   CA   _C9_    38     1.52061   110.85949   165.35544
   39    33 S   CM   _C11    50     1.51167   109.31636   -70.31705
   40    39 S   HC   _H8_    51     1.08980   115.96769   -53.73204
   41    38 S   CA   _C4_    39     1.40511   119.51335  -117.36399
   42    41 S   HA   _H4_    40     1.08762   120.35456     0.06853
   43    39 S   CMA  _C12    52     1.35305   125.55760   123.48854
   44    43 S   OM   _O36    53     1.26262   131.21039     3.29824
   45    41 S   CA   _C5_    41     1.39615   120.81956  -179.78971
   46    45 S   HA   _H5_    42     1.08618   119.82395  -179.97202
   47    43 S   CT   _C13    54     1.53377   116.67881  -176.67539
   48    47 S   HC   _H9_    55     1.10039   110.76206  -141.19948
   49    47 S   HC   _H10    56     1.09965   110.12260   -26.40284
   50    45 S   CA   _C6_    43     1.39071   119.64865     0.09487
   51    47 S   CM   _C14    57     1.51124   112.81098    93.89283
   52    50 S   CA   _C7_    44     1.39174   120.70520     0.05935
   53    52 S   HA   _H6_    45     1.08594   121.02809   179.92338
   54    50 S   OH   _O37    48     1.36622   118.22304  -179.98022
   55    54 S   HO   _H13    49     0.97233   108.51182  -179.84805
   56    51 S   CM   _C15    58     1.34159   124.00114   118.67234
   57    56 S   HC   _H11    59     1.08823   119.34838    -0.54823
   58    38 S   CA   _C8_    46     1.40651   122.05176    63.12149
   59    58 S   HA   _H7_    47     1.08753   120.46153    -0.27906
   60    56 S   CMA  _C16    60     1.45313   120.77317   179.83568
   61    60 S   OM   _O35    61     1.25930   111.66594  -178.90033
   62    60 S   CM   _C17    62     1.34411   117.34009     1.31700
   63    62 S   HC   _H12    63     1.08583   121.08889   179.51261
   64    62 S   CO4  _C18    64     1.47505   122.64134    -0.66735
   65    64 S   O    _O33    65     1.22724   120.78766   178.71336
   66    51 S   OS   _O34    66     1.41435   114.47953   -61.83045
  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   8   5   4   3
  13   6   2   1   1  12   9   3   8   4   7   4   7   3   8   4
   3   6   8   5   3   2   1   7   4   1   1   6   3   4   3   2
   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    58    39    40    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    45    52    58    59    39    40    43    44    47  
   38    41    58    39    40    43  
   36    37  
   37  
    0  
   41    42    45    46    50    52    53    58    59    39    40    43  
   40    43    44    47    48    49    51    41    58  
   43    44    47  
   42    45    46    50    52    58    59    54  
   45    46    50    58  
   44    47    48    49    51    56    66  
   47    48    49    51  
   46    50    52    53    58    54    55  
   50    52    54  
   48    49    51    56    57    60    64    66  
   49    51    56    66  
   51    56    66  
   52    53    58    59    54    55  
   56    57    60    61    62    64    65    66  
   53    58    59    54    55  
   58    59    54  
   55    58  
    0  
   57    60    61    62    63    64    66  
   60    61    62    66  
   59  
    0  
   61    62    63    64    65    66  
   62    63    64  
   63    64    65    66  
   64    65    66  
   65    66  
   66  
    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   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   40   2.4200   0.0300   0.115000   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   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   44   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   51   3.5500   0.0760   0.085000   2.0020   1.7750   0.023028004  -0.852763146
   52   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   54   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   55   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   56   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   57   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   59   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   60   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   61   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   62   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   63   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   64   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   65   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   66   2.8500   0.1400  -0.165000   1.5900   1.4000   0.020110767  -0.896042159
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   317.000  1.510
   38    41   469.000  1.400
   38    58   469.000  1.400
   41    42   367.000  1.080
   41    45   469.000  1.400
   45    46   367.000  1.080
   45    50   469.000  1.400
   50    52   469.000  1.400
   50    54   450.000  1.364
   52    53   367.000  1.080
   52    58   469.000  1.400
   58    59   367.000  1.080
   54    55   553.000  0.945
   39    40   340.000  1.080
   39    43   465.000  1.376
   43    44   745.000  1.250
   43    47   270.000  1.512
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    51   317.000  1.510
   51    56   549.000  1.340
   51    66   440.000  1.360
   56    57   340.000  1.080
   56    60   465.000  1.376
   60    61   745.000  1.250
   60    62   465.000  1.376
   62    63   340.000  1.080
   62    64   320.000  1.462
   64    65   570.000  1.229
   64    66   214.000  1.327
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  112.20000
   33    38    41    70.00000  120.00000
   33    38    58    70.00000  120.00000
   33    39    40    35.00000  117.00000
   33    39    43    70.00000  124.00000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    45    63.00000  120.00000
   38    58    52    63.00000  120.00000
   38    58    59    35.00000  120.00000
   41    45    46    35.00000  120.00000
   41    45    50    63.00000  120.00000
   45    41    42    35.00000  120.00000
   45    50    52    63.00000  120.00000
   45    50    54    70.00000  120.00000
   50    45    46    35.00000  120.00000
   50    52    53    35.00000  120.00000
   50    52    58    63.00000  120.00000
   50    54    55    35.00000  113.00000
   52    58    59    35.00000  120.00000
   58    38    41    63.00000  120.00000
   58    52    53    35.00000  120.00000
   54    50    52    70.00000  120.00000
   39    33    34    35.00000  109.50000
   39    33    38    70.00000  112.99600
   39    43    44    65.00000  137.10300
   39    43    47    65.00000  122.18000
   43    39    40    40.00000  120.50800
   43    47    48    45.00000  110.52000
   43    47    49    45.00000  110.52000
   43    47    51    70.00000  110.12100
   47    43    44    85.00000  112.85300
   47    51    56    70.00000  124.00000
   47    51    66    85.00000  112.85300
   49    47    48    33.00000  107.80000
   51    47    48    35.00000  109.50000
   51    47    49    35.00000  109.50000
   51    56    57    35.00000  120.00000
   51    56    60    70.00000  117.34000
   51    66    64    90.00000  114.22900
   56    60    61    65.00000  137.10300
   56    60    62    70.00000  123.01800
   60    56    57    40.00000  120.50800
   60    62    63    40.00000  120.50800
   60    62    64    60.00000  125.92000
   62    60    61    65.00000  137.10300
   62    64    65    80.00000  123.72100
   62    64    66    90.00000  111.29400
   64    62    63    40.00000  117.72500
   66    51    56    80.00000  120.01400
   66    64    65    83.00000  123.40000
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  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  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    58  -0.16000  1.0 1.0
   29    33    38    58  -0.03200 -1.0 2.0
   29    33    38    58   0.04500  1.0 3.0
   29    33    39    40   0.00000  1.0 1.0
   29    33    39    43   0.42700  1.0 1.0
   29    33    39    43  -0.70350 -1.0 2.0
   29    33    39    43  -0.43150  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    45   3.62500 -1.0 2.0
   33    38    58    52   3.62500 -1.0 2.0
   33    38    58    59   3.62500 -1.0 2.0
   33    39    43    44   7.00000 -1.0 2.0
   33    39    43    47   7.00000 -1.0 2.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    58   0.00000  1.0 1.0
   34    33    39    40   0.33100  1.0 3.0
   34    33    39    43   0.00000  1.0 1.0
   38    33    39    40   0.00000  1.0 1.0
   38    33    39    43   1.44450  1.0 1.0
   38    33    39    43   0.06600 -1.0 2.0
   38    33    39    43   0.29250  1.0 3.0
   38    41    45    46   3.62500 -1.0 2.0
   38    41    45    50   3.62500 -1.0 2.0
   41    38    58    52   3.62500 -1.0 2.0
   41    38    58    59   3.62500 -1.0 2.0
   41    45   -50    52   3.62500 -1.0 2.0
   41    45    50    54   3.62500 -1.0 2.0
   42    41    45    46   3.62500 -1.0 2.0
   42    41    45    50   3.62500 -1.0 2.0
   45    50    52    53   3.62500 -1.0 2.0
   45    50    52    58   3.62500 -1.0 2.0
   45    50    54    55   0.84100 -1.0 2.0
   46    45    50    52   3.62500 -1.0 2.0
   46    45    50    54   3.62500 -1.0 2.0
   50    52   -58    38   3.62500 -1.0 2.0
   50    52    58    59   3.62500 -1.0 2.0
   52    50    54    55   0.84100 -1.0 2.0
   53    52    58    38   3.62500 -1.0 2.0
   53    52    58    59   3.62500 -1.0 2.0
   58    38    41    42   3.62500 -1.0 2.0
   58    38   -41    45   3.62500 -1.0 2.0
   54    50    52    53   3.62500 -1.0 2.0
   54    50    52    58   3.62500 -1.0 2.0
   39    33    38    41   0.18050 -1.0 2.0
   39    33    38    58   0.18050 -1.0 2.0
   39    43    47    48   0.00000  1.0 1.0
   39    43    47    49   0.00000  1.0 1.0
   39    43    47    51  -0.28300  1.0 1.0
   39    43    47    51   0.26700 -1.0 2.0
   39    43    47    51  -0.63300  1.0 3.0
   40    39    43    44   7.00000 -1.0 2.0
   40    39    43    47   7.00000 -1.0 2.0
   43    47    51    56  -0.28300  1.0 1.0
   43    47    51    56   0.26700 -1.0 2.0
   43    47    51    56  -0.63300  1.0 3.0
   43    47    51    66   0.09700  1.0 1.0
   43    47    51    66   0.15600 -1.0 2.0
   43    47    51    66  -0.50800  1.0 3.0
   44    43    47    48   0.00000  1.0 1.0
   44    43    47    49   0.00000  1.0 1.0
   44    43    47    51   0.09700  1.0 1.0
   44    43    47    51   0.15600 -1.0 2.0
   44    43    47    51  -0.50800  1.0 3.0
   47    51    56    57   7.00000 -1.0 2.0
   47    51    56    60   7.00000 -1.0 2.0
   47    51    66    64   2.00000 -1.0 2.0
   48    47    51    56   0.00000  1.0 1.0
   48    47    51    66   0.00000  1.0 1.0
   49    47    51    56   0.00000  1.0 1.0
   49    47    51    66   0.00000  1.0 1.0
   51    56    60    61   7.00000 -1.0 2.0
   51    56    60    62   7.00000 -1.0 2.0
   56    51    66    64  -1.93650  1.0 1.0
   56    51    66    64   2.17750 -1.0 2.0
   56    51    66    64  -0.40250  1.0 3.0
   56    60    62    63   7.00000 -1.0 2.0
   56    60   -62    64   7.00000 -1.0 2.0
   57    56    60    61   7.00000 -1.0 2.0
   57    56    60    62   7.00000 -1.0 2.0
   60    62    64    65   1.00000 -1.0 2.0
   60    62    64    66  -0.56150  1.0 1.0
   60    62    64    66   2.19150 -1.0 2.0
   61    60    62    63   7.00000 -1.0 2.0
   61    60    62    64   7.00000 -1.0 2.0
   62    64   -66    51   2.00000 -1.0 2.0
   63    62    64    65   0.00000  1.0 1.0
   63    62    64    66   1.63100 -1.0 2.0
   65    64    66    51   3.00000 -1.0 2.0
   66    51    56    57   7.00000 -1.0 2.0
   66    51   -56    60   7.00000 -1.0 2.0
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    58    38    33   4.00000 -1.0 2.0
   45    42    41    38   1.10000 -1.0 2.0
   50    46    45    41   1.10000 -1.0 2.0
   52    54    50    45   4.00000 -1.0 2.0
   58    53    52    50   1.10000 -1.0 2.0
   52    59    58    38   1.10000 -1.0 2.0
   33    40    39    43  15.00000 -1.0 2.0
   47    44    43    39  15.00000 -1.0 2.0
   47    66    51    56   1.10000 -1.0 2.0
   60    57    56    51   1.10000 -1.0 2.0
   56    61    60    62   1.10000 -1.0 2.0
   64    63    62    60   1.10000 -1.0 2.0
   62    66    64    65  10.50000 -1.0 2.0
END
