* LIGAND DATABASE FILE (OPLS2005)
*
001      72    75    127    213     378
    1     0 S   NP   _N1_     1    28.67805    94.65178   -21.63814
    2     1 S   H    _HN1     2     1.02955    86.63412    22.12324
    3     1 S   H    _H1_     3     1.02830    30.45166   155.03848
    4     1 S   H    _H2_     4     1.02779    94.17742   -86.05054
    5     1 S   CT   _CA1     5     1.50129   140.56285   140.67272
    6     5 S   HC   _HA1     6     1.09583   105.17016    66.90605
    7     5 S   CO3  _C1_     7     1.53727   112.33103   -53.14023
    8     7 S   O2Z  _O11     8     1.26350   115.00231   -44.97819
    9     7 S   O2Z  _O12     9     1.26219   114.88595   133.90520
   10     5 S   CT   _CB1    10     1.53060   107.38817  -175.34385
   11    10 S   HC   HB11    11     1.09824   109.13953   -51.26438
   12    10 S   HC   HB12    12     1.09815   110.53577    65.26248
   13    10 S   CT   _CG1    13     1.52979   112.68776  -172.39228
   14    13 S   HC   HG11    14     1.09543   110.40244   -66.82493
   15    13 S   HC   HG12    15     1.09666   109.98063    52.35555
   16    13 S   C    _CD1    16     1.51830   112.30722   172.49596
   17    16 S   O    _OE1    17     1.22730   123.27864    -1.16768
   18    16 S   N    _N2_    18     1.38599   111.63634   179.38356
   19    18 S   H    _HN2    19     1.01583   118.98980     0.17017
   20    18 S   CT1  _CA2    20     1.46349   123.46937   177.85625
   21    20 S   HC   _HA2    21     1.09738   109.37874    -6.38856
   22    20 S   C    _C2_    22     1.53466   108.39544  -121.74518
   23    22 S   O    _O2_    23     1.23028   122.45600  -149.16438
   24    20 S   CT   _CB2    32     1.53349   111.32296   115.78906
   25    24 S   HC   HB21    33     1.09406   109.22986    54.73863
   26    24 S   HC   HB22    34     1.09491   110.52411   173.48359
   27    22 S   N    _N3_    24     1.38394   113.50946    38.45241
   28    27 S   H    _HN3    25     1.01624   119.45968    -3.67136
   29    24 S   S    _SG2    35     1.83384   110.68991   -67.23505
   30    27 S   CT   _CA3    26     1.45273   123.16265   176.94905
   31    30 S   HC   HA31    27     1.09551   107.53100   -63.80154
   32    30 S   HC   HA32    28     1.09558   107.95058    52.61572
   33    29 S   CT   _C11    36     1.88407   101.74710   159.31982
   34    33 S   OM   _O40    37     1.31302   107.21989    62.58126
   35    30 S   CO3  _C3_    29     1.52936   114.11425   174.58669
   36    35 S   O2Z  _O31    30     1.26370   116.05913    -0.99012
   37    35 S   O2Z  _O32    31     1.26430   114.41219   179.07423
   38    33 S   CM   _C12    38     1.53150   105.82126  -176.29588
   39    38 S   CM   _C14    39     1.36103   129.24245  -121.27945
   40    38 S   CO4  _C13    57     1.52132   115.79902    72.63855
   41    40 S   O    _O34    58     1.22678   123.59375  -171.20355
   42    39 S   CM   _C19    40     1.47415   125.49426   -34.18403
   43    40 S   CA   _C8_    59     1.48821   118.24871    14.63290
   44    42 S   CM   _C18    41     1.34737   121.79891   150.35234
   45    43 S   CA   _C9_    60     1.39901   120.24751    12.58935
   46    44 S   CM   _C17    42     1.46036   120.11268     2.43847
   47    44 S   CO4  _C23    49     1.48886   119.01009  -179.58504
   48    47 S   O    _O36    50     1.22830   122.55821  -174.61257
   49    45 S   CA   _C4_    61     1.40099   121.13506   175.27851
   50    49 S   HA   _H3_    62     1.08662   120.59054   179.71469
   51    33 S   CO4  _C10    71     1.52134   108.38775   -59.18535
   52    51 S   O    _O33    72     1.22878   125.16623   112.31449
   53    46 S   CM   _C16    43     1.33581   122.38016     4.14028
   54    53 S   HC   _H5_    44     1.08468   121.38509   178.41835
   55    46 S   OH   _O38    47     1.38456   119.32649  -177.98210
   56    55 S   HO   _H7_    48     0.97279   109.36824     0.06853
   57    47 S   CM   _C22    51     1.47053   118.12429     7.18523
   58    57 S   HC   _H6_    52     1.08764   115.24977   168.87155
   59    49 S   CA   _C5_    63     1.39080   119.31475     0.67435
   60    39 S   CO4  _C15    45     1.51625   113.82844   124.62913
   61    60 S   O    _O39    46     1.22645   125.33006    20.32952
   62    57 S   CMA  _C21    53     1.34011   124.67259   -13.11158
   63    62 S   OM   _O37    54     1.26222   129.12113  -178.02286
   64    59 S   CA   _C6_    64     1.39009   120.70348     0.20174
   65    64 S   HA   _H4_    65     1.08715   120.13440   179.48718
   66    59 S   OH   _O42    69     1.36565   121.05084   179.94065
   67    66 S   HO   _H9_    70     0.97207   108.79749    -0.82115
   68    42 S   CO4  _C20    55     1.50803   118.14985   -40.27292
   69    68 S   O    _O35    56     1.23292   119.71455   -17.03160
   70    43 S   CA   _C7_    66     1.40535   121.31805  -171.35160
   71    70 S   OH   _O41    67     1.36995   123.36663     4.12118
   72    71 S   HO   _H8_    68     0.97392   108.77624    -3.06893
  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
  12   6   2   1   1  14  15  10   3  13  11  13   9  10   8   3
   9   4   3   1   5   3   2   1   5   3   6   2   1   3   2   6
   3   2   1   1   1   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    51    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    45    51    52  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    60    40    41    43    45    49    51    52  
   38    39    40    45    51    52  
   36    37  
   37  
    0  
   39    42    44    53    60    61    68    40    41    43    45    70    51    52  
   42    44    46    53    54    60    61    47    62    68    69    40    41    43    51  
   41    43    45    49    64    70    71    51    42    60  
   43    45    70  
   44    46    53    60    61    55    47    48    57    62    63    68    69  
   45    49    50    59    64    65    70    71    72    51    52  
   46    53    54    60    55    56    47    48    57    58    62    68    69  
   49    50    59    64    70    71    66    51    52  
   53    54    60    61    55    56    47    48    57    68  
   48    57    58    62    63    68    53    55  
   57    58    62  
   50    59    64    65    70    66    67    51    52  
   59    64    66    51  
   52    59    70  
    0  
   54    60    61    55    56  
   60    61    55  
   56    60  
    0  
   58    62    63    68    69  
   62    63    68  
   64    65    70    71    66    67  
   61    68  
    0  
   63    68    69  
   68    69  
   65    70    71    72    66    67  
   70    71    66  
   67    70  
    0  
   69  
    0  
   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  -0.175000   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   4.2000   0.3000  -0.012500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   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   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   40   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   42   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   43   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   45   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   46   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   47   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   49   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   50   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   51   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   53   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   54   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   55   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   56   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   57   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   58   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   60   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   61   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   62   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   63   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   64   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   65   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   66   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   67   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   68   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   69   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   70   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   71   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   72   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   570.000  1.307
   33    38   317.000  1.510
   33    51   317.000  1.522
   38    39   549.000  1.340
   38    40   320.000  1.462
   39    42   380.000  1.444
   39    60   320.000  1.462
   42    44   549.000  1.340
   42    68   320.000  1.462
   44    46   380.000  1.444
   44    47   320.000  1.462
   46    53   549.000  1.340
   46    55   510.000  1.338
   53    54   340.000  1.080
   53    60   320.000  1.462
   60    61   570.000  1.229
   55    56   553.000  0.945
   47    48   570.000  1.229
   47    57   320.000  1.462
   57    58   340.000  1.080
   57    62   465.000  1.376
   62    63   745.000  1.250
   62    68   270.000  1.476
   68    69   570.000  1.229
   40    41   570.000  1.229
   40    43   310.000  1.470
   43    45   469.000  1.400
   43    70   469.000  1.400
   45    49   469.000  1.400
   45    51   310.000  1.470
   49    50   367.000  1.080
   49    59   469.000  1.400
   59    64   469.000  1.400
   59    66   450.000  1.364
   64    65   367.000  1.080
   64    70   469.000  1.400
   70    71   450.000  1.364
   71    72   553.000  0.945
   66    67   553.000  0.945
   51    52   570.000  1.229
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    85.00000  114.68000
   29    33    38    75.00000  112.20000
   29    33    51    75.00000  110.18000
   33    38    39    70.00000  124.00000
   33    38    40    65.00000  116.34900
   33    51    45    65.00000  115.47100
   33    51    52    80.00000  120.40000
   38    33    34    85.00000  110.90400
   38    39    42    70.00000  123.01800
   38    39    60    65.00000  118.96000
   38    40    41    80.00000  123.72100
   38    40    43    65.00000  117.02400
   39    42    44    70.00000  123.01800
   39    42    68    65.00000  118.96000
   39    60    53    65.00000  118.65900
   39    60    61    80.00000  123.72100
   42    44    46    70.00000  123.01800
   42    44    47    65.00000  118.96000
   42    68    62    65.00000  118.65900
   42    68    69    80.00000  123.72100
   44    46    53    70.00000  123.01800
   44    46    55    80.00000  121.38400
   44    47    48    80.00000  123.72100
   44    47    57    65.00000  118.65900
   46    53    54    35.00000  120.00000
   46    53    60    65.00000  118.96000
   46    55    56    70.00000  107.45700
   53    60    61    80.00000  123.72100
   60    39    42    65.00000  118.96000
   60    53    54    40.00000  117.72500
   55    46    53    80.00000  121.38400
   47    44    46    65.00000  118.96000
   47    57    58    40.00000  117.72500
   47    57    62    60.00000  125.92000
   57    47    48    80.00000  123.72100
   57    62    63    65.00000  137.10300
   57    62    68    65.00000  114.61000
   62    57    58    40.00000  120.50800
   62    68    69    80.00000  120.81000
   68    42    44    65.00000  118.96000
   68    62    63    85.00000  116.28000
   40    38    39    65.00000  118.96000
   40    43    45    60.00000  119.52600
   40    43    70    60.00000  119.52600
   43    40    41    75.00000  123.78400
   43    45    49    63.00000  120.00000
   43    45    51    60.00000  119.52600
   43    70    64    63.00000  120.00000
   43    70    71    70.00000  120.00000
   45    49    50    35.00000  120.00000
   45    49    59    63.00000  120.00000
   45    51    52    75.00000  123.78400
   49    59    64    63.00000  120.00000
   49    59    66    70.00000  120.00000
   59    49    50    35.00000  120.00000
   59    64    65    35.00000  120.00000
   59    64    70    63.00000  120.00000
   59    66    67    35.00000  113.00000
   64    70    71    70.00000  120.00000
   70    43    45    63.00000  120.00000
   70    64    65    35.00000  120.00000
   70    71    72    35.00000  113.00000
   66    59    64    70.00000  120.00000
   51    33    34    90.00000  108.74100
   51    33    38    70.00000  109.06800
   51    45    49    60.00000  119.52600
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   0.13850  1.0 1.0
   24    29    33    34  -1.34450 -1.0 2.0
   24    29    33    34   0.57400  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    51   0.01700  1.0 1.0
   24    29    33    51  -0.23550 -1.0 2.0
   24    29    33    51   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.42700  1.0 1.0
   29    33    38    39  -0.70350 -1.0 2.0
   29    33    38    39  -0.43150  1.0 3.0
   29    33    38    40   0.09700  1.0 1.0
   29    33    38    40   0.15600 -1.0 2.0
   29    33    38    40  -0.50800  1.0 3.0
   29    33    51    45   0.65300  1.0 1.0
   29    33    51    45  -0.03850 -1.0 2.0
   29    33    51    45   0.33900  1.0 3.0
   29    33    51    52   0.30150 -1.0 2.0
   33    38    39    42   7.00000 -1.0 2.0
   33    38    39    60   7.00000 -1.0 2.0
   33    38    40    41  -0.64400  1.0 1.0
   33    38    40    41   0.26850 -1.0 2.0
   33    38    40    43   1.50000 -1.0 2.0
   34    33    38    39   0.39000  1.0 1.0
   34    33    38    39  -0.05800 -1.0 2.0
   34    33    38    39  -0.55150  1.0 3.0
   34    33    38    40   0.09700  1.0 1.0
   34    33    38    40   0.15600 -1.0 2.0
   34    33    38    40  -0.50800  1.0 3.0
   34    33    51    45   0.65300  1.0 1.0
   34    33    51    45  -0.03850 -1.0 2.0
   34    33    51    45   0.33900  1.0 3.0
   34    33    51    52   0.30150 -1.0 2.0
   38    33    51    45   0.65300  1.0 1.0
   38    33    51    45  -0.03850 -1.0 2.0
   38    33    51    45   0.33900  1.0 3.0
   38    33    51    52   0.30150 -1.0 2.0
   38    39    42    44   0.28850  1.0 1.0
   38    39    42    44   2.61350 -1.0 2.0
   38    39    42    44   0.78400  1.0 3.0
   38    39    42    68  -0.18600  1.0 3.0
   38    39    60    53  -1.18350  1.0 1.0
   38    39    60    53   1.45950 -1.0 2.0
   38    39    60    61   1.00000 -1.0 2.0
   38    40   -43    45  -0.11500  1.0 1.0
   38    40   -43    45   1.10450 -1.0 2.0
   38    40   -43    45  -0.48050  1.0 3.0
   38    40    43    70  -0.11500  1.0 1.0
   38    40    43    70   1.10450 -1.0 2.0
   38    40    43    70  -0.48050  1.0 3.0
   39    38    40    41   1.00000 -1.0 2.0
   39    38    40    43  -1.65800  1.0 1.0
   39    38    40    43   0.77650 -1.0 2.0
   39    42    44    46   7.00000 -1.0 2.0
   39    42    44    47   7.00000 -1.0 2.0
   39    42    68    62  -1.18350  1.0 1.0
   39    42    68    62   1.45950 -1.0 2.0
   39    42    68    69   1.00000 -1.0 2.0
   42    39    60    53  -1.18350  1.0 1.0
   42    39    60    53   1.45950 -1.0 2.0
   42    39    60    61   1.00000 -1.0 2.0
   42    44   -46    53   0.28850  1.0 1.0
   42    44   -46    53   2.61350 -1.0 2.0
   42    44   -46    53   0.78400  1.0 3.0
   42    44    46    55   0.50950  1.0 1.0
   42    44    46    55   0.56650 -1.0 2.0
   42    44    46    55   0.34050  1.0 3.0
   42    44    47    48   1.00000 -1.0 2.0
   42    44    47    57  -1.18350  1.0 1.0
   42    44    47    57   1.45950 -1.0 2.0
   44    42    68    62  -1.18350  1.0 1.0
   44    42    68    62   1.45950 -1.0 2.0
   44    42    68    69   1.00000 -1.0 2.0
   44    46    53    54   7.00000 -1.0 2.0
   44    46    53    60   7.00000 -1.0 2.0
   44    46    55    56  -0.66100  1.0 1.0
   44    46    55    56   1.20850 -1.0 2.0
   44    46    55    56  -0.36000  1.0 3.0
   44    47    57    58   0.93700 -1.0 2.0
   44    47   -57    62  -1.18350  1.0 1.0
   44    47   -57    62   1.45950 -1.0 2.0
   46    44    47    48   1.00000 -1.0 2.0
   46    44    47    57  -1.18350  1.0 1.0
   46    44    47    57   1.45950 -1.0 2.0
   46    53   -60    39  -1.18350  1.0 1.0
   46    53   -60    39   1.45950 -1.0 2.0
   46    53    60    61   1.00000 -1.0 2.0
   53    46    55    56  -0.66100  1.0 1.0
   53    46    55    56   1.20850 -1.0 2.0
   53    46    55    56  -0.36000  1.0 3.0
   54    53    60    39   0.93700 -1.0 2.0
   54    53    60    61   0.00000  1.0 1.0
   60    39   -42    44  -0.18600  1.0 3.0
   60    39    42    68   1.08500 -1.0 2.0
   55    46    53    54   7.00000 -1.0 2.0
   55    46    53    60   7.00000 -1.0 2.0
   47    44    46    53  -0.18600  1.0 3.0
   47    44    46    55   1.08500 -1.0 2.0
   47    57    62    63   7.00000 -1.0 2.0
   47    57    62    68   7.00000 -1.0 2.0
   48    47    57    58   0.00000  1.0 1.0
   48    47    57    62   1.00000 -1.0 2.0
   57    62   -68    42  -1.18350  1.0 1.0
   57    62   -68    42   1.45950 -1.0 2.0
   57    62    68    69   1.00000 -1.0 2.0
   58    57    62    63   7.00000 -1.0 2.0
   58    57    62    68   7.00000 -1.0 2.0
   63    62    68    42   1.50000 -1.0 2.0
   63    62    68    69  -0.11900  1.0 1.0
   63    62    68    69   0.76850 -1.0 2.0
   63    62    68    69   0.14100  1.0 3.0
   68    42    44    46   7.00000 -1.0 2.0
   68    42   -44    47   7.00000 -1.0 2.0
   40    38    39    42   7.00000 -1.0 2.0
   40    38    39    60   7.00000 -1.0 2.0
   40    43    45    49   3.62500 -1.0 2.0
   40    43    45    51   3.62500 -1.0 2.0
   40    43    70    64   3.62500 -1.0 2.0
   40    43    70    71   3.62500 -1.0 2.0
   41    40    43    45   1.05000 -1.0 2.0
   41    40    43    70   1.05000 -1.0 2.0
   43    45    49    50   3.62500 -1.0 2.0
   43    45    49    59   3.62500 -1.0 2.0
   43    45   -51    33   2.26350  1.0 1.0
   43    45   -51    33   0.76750 -1.0 2.0
   43    45   -51    33   0.22500  1.0 3.0
   43    45    51    52   1.05000 -1.0 2.0
   43    70    71    72   0.84100 -1.0 2.0
   45    43    70    64   3.62500 -1.0 2.0
   45    43    70    71   3.62500 -1.0 2.0
   45    49   -59    64   3.62500 -1.0 2.0
   45    49    59    66   3.62500 -1.0 2.0
   49    45    51    33   2.26350  1.0 1.0
   49    45    51    33   0.76750 -1.0 2.0
   49    45    51    33   0.22500  1.0 3.0
   49    45    51    52   1.05000 -1.0 2.0
   49    59    64    65   3.62500 -1.0 2.0
   49    59    64    70   3.62500 -1.0 2.0
   49    59    66    67   0.84100 -1.0 2.0
   50    49    59    64   3.62500 -1.0 2.0
   50    49    59    66   3.62500 -1.0 2.0
   59    64   -70    43   3.62500 -1.0 2.0
   59    64    70    71   3.62500 -1.0 2.0
   64    59    66    67   0.84100 -1.0 2.0
   64    70    71    72   0.84100 -1.0 2.0
   65    64    70    43   3.62500 -1.0 2.0
   65    64    70    71   3.62500 -1.0 2.0
   70    43   -45    49   3.62500 -1.0 2.0
   70    43    45    51   3.62500 -1.0 2.0
   66    59    64    65   3.62500 -1.0 2.0
   66    59    64    70   3.62500 -1.0 2.0
   51    33    38    39  -0.51250  1.0 1.0
   51    33    38    39  -0.88800 -1.0 2.0
   51    33    38    39   0.08850  1.0 3.0
   51    33   -38    40   0.09700  1.0 1.0
   51    33   -38    40   0.15600 -1.0 2.0
   51    33   -38    40  -0.50800  1.0 3.0
   51    45    49    50   3.62500 -1.0 2.0
   51    45    49    59   3.62500 -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
   33    40    38    39   1.10000 -1.0 2.0
   42    60    39    38   1.10000 -1.0 2.0
   39    68    42    44   1.10000 -1.0 2.0
   46    47    44    42   1.10000 -1.0 2.0
   44    55    46    53   1.10000 -1.0 2.0
   60    54    53    46   1.10000 -1.0 2.0
   39    53    60    61  10.50000 -1.0 2.0
   44    57    47    48  10.50000 -1.0 2.0
   47    58    57    62   1.10000 -1.0 2.0
   68    63    62    57   1.10000 -1.0 2.0
   42    62    68    69  10.50000 -1.0 2.0
   38    43    40    41  10.50000 -1.0 2.0
   45    70    43    40   4.00000 -1.0 2.0
   49    51    45    43   4.00000 -1.0 2.0
   59    50    49    45   1.10000 -1.0 2.0
   64    66    59    49   4.00000 -1.0 2.0
   70    65    64    59   1.10000 -1.0 2.0
   64    71    70    43   4.00000 -1.0 2.0
   33    45    51    52  10.50000 -1.0 2.0
END
