* LIGAND DATABASE FILE (OPLS2005)
*
001      73    75    145    233     432
    1     0 S   NP   _N1_     1    28.81375    94.83369   -24.45427
    2     1 S   H    _HN1     2     1.02791   113.27622   -93.63572
    3     1 S   H    _H1_     3     1.02949    80.16398    12.23595
    4     1 S   H    _H2_     4     1.02828    27.33545  -177.64890
    5     1 S   CT   _CA1     5     1.50118   126.46302   120.42460
    6     5 S   HC   _HA1     6     1.09575   105.18196    84.96176
    7     5 S   CO3  _C1_     7     1.53780   112.43023   -35.26222
    8     7 S   O2Z  _O11     8     1.26375   115.00941   -43.40275
    9     7 S   O2Z  _O12     9     1.26237   114.94127   135.64641
   10     5 S   CT   _CB1    10     1.53068   107.40914  -157.07964
   11    10 S   HC   HB11    11     1.09838   109.35414   -49.62199
   12    10 S   HC   HB12    12     1.09812   110.46940    66.97945
   13    10 S   CT   _CG1    13     1.53004   112.61338  -170.57302
   14    13 S   HC   HG11    14     1.09577   110.67770   -66.31119
   15    13 S   HC   HG12    15     1.09671   109.74439    52.92704
   16    13 S   C    _CD1    16     1.51808   112.10943   173.39046
   17    16 S   O    _OE1    17     1.22750   123.22530     9.43403
   18    16 S   N    _N2_    18     1.38639   111.73894  -170.59859
   19    18 S   H    _HN2    19     1.01579   119.06821     1.14432
   20    18 S   CT1  _CA2    20     1.46212   123.40231   177.27265
   21    20 S   HC   _HA2    21     1.09699   109.11982     6.28806
   22    20 S   C    _C2_    22     1.53682   109.22372  -109.05483
   23    22 S   O    _O2_    23     1.23089   122.21968  -151.98021
   24    20 S   CT   _CB2    32     1.53437   111.59735   128.19755
   25    24 S   HC   HB21    33     1.09527   109.43480    55.52536
   26    24 S   HC   HB22    34     1.09185   110.17586   173.14193
   27    22 S   N    _N3_    24     1.38304   113.93189    35.64800
   28    27 S   H    _HN3    25     1.01546   119.57594    -3.57823
   29    24 S   S    _SG2    35     1.83453   111.31328   -63.81493
   30    27 S   CT   _CA3    26     1.45269   123.25813   177.04706
   31    30 S   HC   HA31    27     1.09548   107.54654   -63.98509
   32    30 S   HC   HA32    28     1.09556   107.95660    52.46093
   33    29 S   CT   _C15    36     1.88603   103.14293  -140.31045
   34    30 S   CO3  _C3_    29     1.52963   114.05667   174.45324
   35    34 S   O2Z  _O31    30     1.26381   116.08387     0.17359
   36    34 S   O2Z  _O32    31     1.26427   114.41307  -179.78060
   37    33 S   CM   _C8_    37     1.54329   111.39178   -41.84769
   38    33 S   CT   _C14    57     1.62800   111.53431    86.42478
   39    33 S   CT   _C16    70     1.55636   101.89111  -154.49686
   40    39 S   HC   _H16    71     1.09638   112.56546   -58.16629
   41    39 S   HC   _H17    72     1.09372   111.93661  -179.08443
   42    39 S   HC   _H18    73     1.09714   112.63724    61.64216
   43    37 S   CMA  _C7_    38     1.35751   130.04315   -44.55667
   44    43 S   OM   _O33    39     1.25796   136.29138     1.68342
   45    38 S   CT   _C17    58     1.56253   114.37548   -28.40847
   46    45 S   HC   _H19    59     1.09540   112.03772    67.34969
   47    45 S   HC   _H20    60     1.08992   113.50627   -55.52244
   48    45 S   HC   _H21    61     1.09771   110.66101  -174.84094
   49    38 S   CT   _C18    62     1.55532   112.43702    88.79530
   50    49 S   HC   _H22    63     1.09606   111.04301   -60.68457
   51    49 S   HC   _H23    64     1.09696   110.91626  -179.69162
   52    49 S   HC   _H24    65     1.09248   113.37247    60.69488
   53    43 S   CT   _C6_    40     1.51661   110.37212  -175.91855
   54    53 S   HC   _H8_    41     1.09809   110.50714   102.17221
   55    53 S   HC   _H9_    42     1.09755   113.18915  -135.74599
   56    53 S   CT   _C5_    43     1.52901   102.90516   -17.33670
   57    56 S   HC   _H3_    44     1.10135   107.71955   -84.36093
   58    37 S   CT   _C9_    45     1.52706   119.54726   143.48360
   59    56 S   CT   _C4_    66     1.52191   112.53258   157.98105
   60    59 S   HC   _H5_    67     1.09455   112.01685   -54.65855
   61    59 S   HC   _H6_    68     1.09438   111.00844  -176.05797
   62    59 S   HC   _H7_    69     1.09545   110.20853    64.59337
   63    58 S   CT   _C10    46     1.53824   109.74771    70.72545
   64    63 S   HC   _H10    47     1.09507   112.14582   156.00091
   65    63 S   HC   _H11    48     1.09542   113.39154    34.64393
   66    63 S   CT   _C11    49     1.53455   104.45718   -87.07224
   67    66 S   HC   _H12    50     1.09075   112.11480   122.56709
   68    66 S   HC   _H13    51     1.09761   108.67281  -120.35973
   69    66 S   CT   _C12    52     1.54095   105.90826    -3.02517
   70    69 S   HC   _H4_    53     1.09715   109.26216  -143.55689
   71    58 S   CT   _C13    54     1.51928   112.09904   -42.01573
   72    71 S   HC   _H14    55     1.09204   113.27648   -54.04184
   73    71 S   HC   _H15    56     1.09772   111.16741  -174.69238
  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  12   5   4   3
  24   2   1   1  24  23   8   2   1   1  10   5  11   4   3   2
   7   3   2   1  11   5   4  14   7  15   5   2   1   1  10   6
   5   7   4   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    43    58    69    38    45    49    39    40    41    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    43    44    53    56    58    63    66    69    70    71    38    45    46    47    48    49    50    51    52    39    40    41    42  
   35    36  
   36  
    0  
   43    44    53    54    55    56    57    58    63    64    65    66    69    71    72    73    38    45    49    59    39    40    41    42  
   45    46    47    48    49    50    51    52    39    40    41    42    43    58    63    66    67    68    69    70    71    72    73  
   40    41    42    43    45    49    58    69  
   41    42  
   42  
    0  
   44    53    54    55    56    57    58    63    71    59  
   53    54    55    56    58  
   46    47    48    49    50    51    52    66    69    70    71  
   47    48    49    69  
   48    49    69  
   49    69  
   50    51    52    66    69    70    71  
   51    52    69  
   52    69  
   69  
   54    55    56    57    58    63    71    59    60    61    62  
   55    56    57    58    59  
   56    57    58    59  
   57    58    63    64    65    66    69    71    72    73    59    60    61    62  
   58    63    71    59    60    61    62  
   63    64    65    66    67    68    69    70    71    72    73    59    60    61    62  
   60    61    62    63    71  
   61    62  
   62  
    0  
   64    65    66    67    68    69    70    71    72    73  
   65    66    67    68    69    71  
   66    67    68    69    71  
   67    68    69    70    71    72    73  
   68    69    70    71  
   69    70    71  
   70    71    72    73  
   71    72    73  
   72    73  
   73  
    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   0.167500   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   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   39   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   59   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   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  1.510
   33    38   268.000  1.529
   33    39   268.000  1.529
   37    43   465.000  1.376
   37    58   317.000  1.510
   43    44   745.000  1.250
   43    53   270.000  1.512
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   268.000  1.529
   56    57   340.000  1.090
   56    58   268.000  1.529
   56    59   268.000  1.529
   58    63   268.000  1.529
   58    71   268.000  1.529
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   268.000  1.529
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   268.000  1.529
   69    70   340.000  1.090
   69    71   268.000  1.529
   69    38   268.000  1.529
   71    72   340.000  1.090
   71    73   340.000  1.090
   38    45   268.000  1.529
   38    49   268.000  1.529
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   340.000  1.090
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   340.000  1.090
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   340.000  1.090
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    42   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  112.20000
   29    33    38    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    43    70.00000  124.00000
   33    37    58    65.00000  117.92700
   33    38    69    58.35000  112.70000
   33    38    45    58.35000  112.70000
   33    38    49    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    42    37.50000  110.70000
   37    43    44    65.00000  137.10300
   37    43    53    65.00000  122.18000
   37    58    56    70.00000  112.02700
   37    58    63    70.00000  112.02700
   37    58    71    70.00000  112.02700
   43    53    54    45.00000  110.52000
   43    53    55    45.00000  110.52000
   43    53    56    70.00000  112.02700
   53    43    44    85.00000  112.85300
   53    56    57    37.50000  110.70000
   53    56    58    58.35000  112.70000
   53    56    59    58.35000  112.70000
   55    53    54    33.00000  107.80000
   56    53    54    37.50000  110.70000
   56    53    55    37.50000  110.70000
   56    58    63    58.35000  112.70000
   56    58    71    58.35000  112.70000
   56    59    60    37.50000  110.70000
   56    59    61    37.50000  110.70000
   56    59    62    37.50000  110.70000
   58    37    43    70.00000  124.00000
   58    56    57    37.50000  110.70000
   58    63    64    37.50000  110.70000
   58    63    65    37.50000  110.70000
   58    63    66    58.35000  112.70000
   58    71    69    58.35000  112.70000
   58    71    72    37.50000  110.70000
   58    71    73    37.50000  110.70000
   63    66    67    37.50000  110.70000
   63    66    68    37.50000  110.70000
   63    66    69    58.35000  112.70000
   65    63    64    33.00000  107.80000
   66    63    64    37.50000  110.70000
   66    63    65    37.50000  110.70000
   66    69    70    37.50000  110.70000
   66    69    71    58.35000  112.70000
   66    69    38    58.35000  112.70000
   68    66    67    33.00000  107.80000
   69    66    67    37.50000  110.70000
   69    66    68    37.50000  110.70000
   69    71    72    37.50000  110.70000
   69    71    73    37.50000  110.70000
   69    38    45    58.35000  112.70000
   69    38    49    58.35000  112.70000
   71    58    63    58.35000  112.70000
   71    69    70    37.50000  110.70000
   73    71    72    33.00000  107.80000
   38    33    37    70.00000  112.02700
   38    69    70    37.50000  110.70000
   38    69    71    58.35000  112.70000
   38    45    46    37.50000  110.70000
   38    45    47    37.50000  110.70000
   38    45    48    37.50000  110.70000
   38    49    50    37.50000  110.70000
   38    49    51    37.50000  110.70000
   38    49    52    37.50000  110.70000
   47    45    46    33.00000  107.80000
   48    45    46    33.00000  107.80000
   48    45    47    33.00000  107.80000
   49    38    45    58.35000  112.70000
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    33.00000  107.80000
   59    56    57    37.50000  110.70000
   59    56    58    58.35000  112.70000
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    33.00000  107.80000
   39    33    37    70.00000  112.02700
   39    33    38    58.35000  112.70000
   41    39    40    33.00000  107.80000
   42    39    40    33.00000  107.80000
   42    39    41    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  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    43   0.42700  1.0 1.0
   29    33    37    43  -0.70350 -1.0 2.0
   29    33    37    43  -0.43150  1.0 3.0
   29    33    37    58   0.30250  1.0 1.0
   29    33    37    58  -0.14950 -1.0 2.0
   29    33    37    58   0.36900  1.0 3.0
   29    33    38    69   0.44750  1.0 1.0
   29    33    38    69  -0.17800 -1.0 2.0
   29    33    38    69   0.20200  1.0 3.0
   29    33    38    45   0.44750  1.0 1.0
   29    33    38    45  -0.17800 -1.0 2.0
   29    33    38    45   0.20200  1.0 3.0
   29    33    38    49   0.44750  1.0 1.0
   29    33    38    49  -0.17800 -1.0 2.0
   29    33    38    49   0.20200  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    42   0.15000  1.0 3.0
   33    37    43    44   7.00000 -1.0 2.0
   33    37    43    53   7.00000 -1.0 2.0
   33    37    58    56   0.46850  1.0 1.0
   33    37    58    56   0.08550 -1.0 2.0
   33    37    58    56   0.09800  1.0 3.0
   33    37    58    63   0.46850  1.0 1.0
   33    37    58    63   0.08550 -1.0 2.0
   33    37    58    63   0.09800  1.0 3.0
   33    37    58    71   0.46850  1.0 1.0
   33    37    58    71   0.08550 -1.0 2.0
   33    37    58    71   0.09800  1.0 3.0
   33    38    45    46   0.15000  1.0 3.0
   33    38    45    47   0.15000  1.0 3.0
   33    38    45    48   0.15000  1.0 3.0
   33    38    49    50   0.15000  1.0 3.0
   33    38    49    51   0.15000  1.0 3.0
   33    38    49    52   0.15000  1.0 3.0
   37    33    38    69   0.34400  1.0 1.0
   37    33    38    69   0.09450 -1.0 2.0
   37    33    38    69   0.11100  1.0 3.0
   37    33    38    45   0.34400  1.0 1.0
   37    33    38    45   0.09450 -1.0 2.0
   37    33    38    45   0.11100  1.0 3.0
   37    33    38    49   0.34400  1.0 1.0
   37    33    38    49   0.09450 -1.0 2.0
   37    33    38    49   0.11100  1.0 3.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    41   0.15000  1.0 3.0
   37    33    39    42   0.15000  1.0 3.0
   37    43    53    54   0.00000  1.0 1.0
   37    43    53    55   0.00000  1.0 1.0
   37    43   -53    56   0.09850  1.0 1.0
   37    43   -53    56   0.15250 -1.0 2.0
   37    43   -53    56  -0.50650  1.0 3.0
   37    58    63    64   0.15000  1.0 3.0
   37    58    63    65   0.15000  1.0 3.0
   37    58    63    66   0.34400  1.0 1.0
   37    58    63    66   0.09450 -1.0 2.0
   37    58    63    66   0.11100  1.0 3.0
   37    58   -71    69   0.34400  1.0 1.0
   37    58   -71    69   0.09450 -1.0 2.0
   37    58   -71    69   0.11100  1.0 3.0
   37    58    71    72   0.15000  1.0 3.0
   37    58    71    73   0.15000  1.0 3.0
   43    37   -58    56   0.09850  1.0 1.0
   43    37   -58    56   0.15250 -1.0 2.0
   43    37   -58    56  -0.50650  1.0 3.0
   43    37    58    63   0.09850  1.0 1.0
   43    37    58    63   0.15250 -1.0 2.0
   43    37    58    63  -0.50650  1.0 3.0
   43    37    58    71   0.09850  1.0 1.0
   43    37    58    71   0.15250 -1.0 2.0
   43    37    58    71  -0.50650  1.0 3.0
   43    53    56    57   0.15000  1.0 3.0
   43    53   -56    58   0.34400  1.0 1.0
   43    53   -56    58   0.09450 -1.0 2.0
   43    53   -56    58   0.11100  1.0 3.0
   43    53    56    59   0.34400  1.0 1.0
   43    53    56    59   0.09450 -1.0 2.0
   43    53    56    59   0.11100  1.0 3.0
   44    43    53    54   0.00000  1.0 1.0
   44    43    53    55   0.00000  1.0 1.0
   44    43    53    56   0.09700  1.0 1.0
   44    43    53    56   0.15600 -1.0 2.0
   44    43    53    56  -0.50800  1.0 3.0
   53    56   -58    37   0.34400  1.0 1.0
   53    56   -58    37   0.09450 -1.0 2.0
   53    56   -58    37   0.11100  1.0 3.0
   53    56    58    63   0.56750  1.0 1.0
   53    56    58    63  -0.07550 -1.0 2.0
   53    56    58    63   0.20000  1.0 3.0
   53    56    58    71   0.56750  1.0 1.0
   53    56    58    71  -0.07550 -1.0 2.0
   53    56    58    71   0.20000  1.0 3.0
   53    56    59    60   0.15000  1.0 3.0
   53    56    59    61   0.15000  1.0 3.0
   53    56    59    62   0.15000  1.0 3.0
   54    53    56    57   0.15000  1.0 3.0
   54    53    56    58   0.15000  1.0 3.0
   54    53    56    59   0.15000  1.0 3.0
   55    53    56    57   0.15000  1.0 3.0
   55    53    56    58   0.15000  1.0 3.0
   55    53    56    59   0.15000  1.0 3.0
   56    58    63    64   0.15000  1.0 3.0
   56    58    63    65   0.15000  1.0 3.0
   56    58    63    66   0.56750  1.0 1.0
   56    58    63    66  -0.07550 -1.0 2.0
   56    58    63    66   0.20000  1.0 3.0
   56    58    71    69   0.56750  1.0 1.0
   56    58    71    69  -0.07550 -1.0 2.0
   56    58    71    69   0.20000  1.0 3.0
   56    58    71    72   0.15000  1.0 3.0
   56    58    71    73   0.15000  1.0 3.0
   57    56    58    37   0.15000  1.0 3.0
   57    56    58    63   0.15000  1.0 3.0
   57    56    58    71   0.15000  1.0 3.0
   57    56    59    60   0.15000  1.0 3.0
   57    56    59    61   0.15000  1.0 3.0
   57    56    59    62   0.15000  1.0 3.0
   58    37    43    44   7.00000 -1.0 2.0
   58    37   -43    53   7.00000 -1.0 2.0
   58    56    59    60   0.15000  1.0 3.0
   58    56    59    61   0.15000  1.0 3.0
   58    56    59    62   0.15000  1.0 3.0
   58    63    66    67   0.15000  1.0 3.0
   58    63    66    68   0.15000  1.0 3.0
   58    63   -66    69   0.56750  1.0 1.0
   58    63   -66    69  -0.07550 -1.0 2.0
   58    63   -66    69   0.20000  1.0 3.0
   63    58   -71    69   0.56750  1.0 1.0
   63    58   -71    69  -0.07550 -1.0 2.0
   63    58   -71    69   0.20000  1.0 3.0
   63    58    71    72   0.15000  1.0 3.0
   63    58    71    73   0.15000  1.0 3.0
   63    66    69    70   0.15000  1.0 3.0
   63    66   -69    71   0.56750  1.0 1.0
   63    66   -69    71  -0.07550 -1.0 2.0
   63    66   -69    71   0.20000  1.0 3.0
   63    66    69    38   0.56750  1.0 1.0
   63    66    69    38  -0.07550 -1.0 2.0
   63    66    69    38   0.20000  1.0 3.0
   64    63    66    67   0.15000  1.0 3.0
   64    63    66    68   0.15000  1.0 3.0
   64    63    66    69   0.15000  1.0 3.0
   65    63    66    67   0.15000  1.0 3.0
   65    63    66    68   0.15000  1.0 3.0
   65    63    66    69   0.15000  1.0 3.0
   66    69   -71    58   0.56750  1.0 1.0
   66    69   -71    58  -0.07550 -1.0 2.0
   66    69   -71    58   0.20000  1.0 3.0
   66    69    71    72   0.15000  1.0 3.0
   66    69    71    73   0.15000  1.0 3.0
   66    69    38    33   0.56750  1.0 1.0
   66    69    38    33  -0.07550 -1.0 2.0
   66    69    38    33   0.20000  1.0 3.0
   66    69    38    45   0.56750  1.0 1.0
   66    69    38    45  -0.07550 -1.0 2.0
   66    69    38    45   0.20000  1.0 3.0
   66    69    38    49   0.56750  1.0 1.0
   66    69    38    49  -0.07550 -1.0 2.0
   66    69    38    49   0.20000  1.0 3.0
   67    66    69    70   0.15000  1.0 3.0
   67    66    69    71   0.15000  1.0 3.0
   67    66    69    38   0.15000  1.0 3.0
   68    66    69    70   0.15000  1.0 3.0
   68    66    69    71   0.15000  1.0 3.0
   68    66    69    38   0.15000  1.0 3.0
   69    38    45    46   0.15000  1.0 3.0
   69    38    45    47   0.15000  1.0 3.0
   69    38    45    48   0.15000  1.0 3.0
   69    38    49    50   0.15000  1.0 3.0
   69    38    49    51   0.15000  1.0 3.0
   69    38    49    52   0.15000  1.0 3.0
   70    69    71    58   0.15000  1.0 3.0
   70    69    71    72   0.15000  1.0 3.0
   70    69    71    73   0.15000  1.0 3.0
   70    69    38    33   0.15000  1.0 3.0
   70    69    38    45   0.15000  1.0 3.0
   70    69    38    49   0.15000  1.0 3.0
   71    58    63    64   0.15000  1.0 3.0
   71    58    63    65   0.15000  1.0 3.0
   71    58   -63    66   0.56750  1.0 1.0
   71    58   -63    66  -0.07550 -1.0 2.0
   71    58   -63    66   0.20000  1.0 3.0
   71    69   -38    33   0.56750  1.0 1.0
   71    69   -38    33  -0.07550 -1.0 2.0
   71    69   -38    33   0.20000  1.0 3.0
   71    69    38    45   0.56750  1.0 1.0
   71    69    38    45  -0.07550 -1.0 2.0
   71    69    38    45   0.20000  1.0 3.0
   71    69    38    49   0.56750  1.0 1.0
   71    69    38    49  -0.07550 -1.0 2.0
   71    69    38    49   0.20000  1.0 3.0
   38    33    37    43   0.09850  1.0 1.0
   38    33    37    43   0.15250 -1.0 2.0
   38    33    37    43  -0.50650  1.0 3.0
   38    33    37    58   0.46850  1.0 1.0
   38    33    37    58   0.08550 -1.0 2.0
   38    33    37    58   0.09800  1.0 3.0
   38    33    39    40   0.15000  1.0 3.0
   38    33    39    41   0.15000  1.0 3.0
   38    33    39    42   0.15000  1.0 3.0
   38    69   -71    58   0.56750  1.0 1.0
   38    69   -71    58  -0.07550 -1.0 2.0
   38    69   -71    58   0.20000  1.0 3.0
   38    69    71    72   0.15000  1.0 3.0
   38    69    71    73   0.15000  1.0 3.0
   45    38    49    50   0.15000  1.0 3.0
   45    38    49    51   0.15000  1.0 3.0
   45    38    49    52   0.15000  1.0 3.0
   49    38    45    46   0.15000  1.0 3.0
   49    38    45    47   0.15000  1.0 3.0
   49    38    45    48   0.15000  1.0 3.0
   59    56    58    37   0.34400  1.0 1.0
   59    56    58    37   0.09450 -1.0 2.0
   59    56    58    37   0.11100  1.0 3.0
   59    56    58    63   0.56750  1.0 1.0
   59    56    58    63  -0.07550 -1.0 2.0
   59    56    58    63   0.20000  1.0 3.0
   59    56    58    71   0.56750  1.0 1.0
   59    56    58    71  -0.07550 -1.0 2.0
   59    56    58    71   0.20000  1.0 3.0
   39    33    37    43   0.09850  1.0 1.0
   39    33    37    43   0.15250 -1.0 2.0
   39    33    37    43  -0.50650  1.0 3.0
   39    33    37    58   0.46850  1.0 1.0
   39    33    37    58   0.08550 -1.0 2.0
   39    33    37    58   0.09800  1.0 3.0
   39    33    38    69   0.56750  1.0 1.0
   39    33    38    69  -0.07550 -1.0 2.0
   39    33    38    69   0.20000  1.0 3.0
   39    33    38    45   0.56750  1.0 1.0
   39    33    38    45  -0.07550 -1.0 2.0
   39    33    38    45   0.20000  1.0 3.0
   39    33    38    49   0.56750  1.0 1.0
   39    33    38    49  -0.07550 -1.0 2.0
   39    33    38    49   0.20000  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    58    37    43   1.10000 -1.0 2.0
   53    44    43    37   1.10000 -1.0 2.0
END
