* LIGAND DATABASE FILE (OPLS2005)
*
001      71    73    137    221     410
    1     0 S   NP   _N1_     1    29.08736    92.88915   -22.31268
    2     1 S   H    _HN1     2     1.02773    99.20703   -79.76255
    3     1 S   H    _H1_     3     1.02966    94.12357    29.57507
    4     1 S   H    _H2_     4     1.02828    19.60541   161.86038
    5     1 S   CT   _CA1     5     1.50149   130.05996   150.60893
    6     5 S   HC   _HA1     6     1.09580   105.19767    63.17006
    7     5 S   CO3  _C1_     7     1.53781   112.43658   -56.87819
    8     7 S   O2Z  _O11     8     1.26352   115.01683   -41.82505
    9     7 S   O2Z  _O12     9     1.26253   114.91720   137.24907
   10     5 S   CT   _CB1    10     1.53077   107.35936  -179.03734
   11    10 S   HC   HB11    11     1.09820   109.16929   -51.44975
   12    10 S   HC   HB12    12     1.09823   110.42913    65.01265
   13    10 S   CT   _CG1    13     1.53011   112.79963  -172.67812
   14    13 S   HC   HG11    14     1.09596   110.29675   -64.93813
   15    13 S   HC   HG12    15     1.09642   110.13085    54.31007
   16    13 S   C    _CD1    16     1.51793   112.25235   174.43169
   17    16 S   O    _OE1    17     1.22742   123.23054    -7.97974
   18    16 S   N    _N2_    18     1.38681   111.74713   172.73693
   19    18 S   H    _HN2    19     1.01582   119.12529     1.31254
   20    18 S   CT1  _CA2    20     1.46058   123.18494  -179.13295
   21    20 S   HC   _HA2    21     1.09578   109.23731    -7.29627
   22    20 S   C    _C2_    22     1.53457   108.96887  -122.51094
   23    22 S   O    _O2_    23     1.23043   122.03531  -148.53013
   24    20 S   CT   _CB2    32     1.53449   111.78566   114.91455
   25    24 S   HC   HB21    33     1.09659   109.55153    64.09371
   26    24 S   HC   HB22    34     1.09576   110.81768  -178.67559
   27    22 S   N    _N3_    24     1.38452   113.56933    39.03136
   28    27 S   H    _HN3    25     1.01511   118.93125    -0.81229
   29    24 S   S    _SG2    35     1.82862   114.87966   -55.63428
   30    27 S   CT   _CA3    26     1.45447   123.48096   174.85863
   31    30 S   HC   HA31    27     1.09521   109.26943    23.94482
   32    30 S   HC   HA32    28     1.09496   107.12233   140.96925
   33    29 S   CT   _C18    36     1.82588    99.98350   -66.88841
   34    33 S   HC   _H20    37     1.09410   107.39931   -59.15935
   35    33 S   HC   _H21    38     1.09343   109.36462    58.36910
   36    30 S   CO3  _C3_    29     1.52926   113.06550   -99.54073
   37    36 S   O2Z  _O31    30     1.26406   115.39562   -44.57588
   38    36 S   O2Z  _O32    31     1.26351   114.98850   136.33110
   39    33 S   CT   _C9_    39     1.52998   110.96303   179.86878
   40    39 S   HC   _H4_    40     1.09762   112.05525    41.96980
   41    39 S   CO4  _C10    41     1.51027   113.01002   -80.21696
   42    41 S   O    _O33    42     1.22082   126.56424    41.72406
   43    41 S   OS   _O34    43     1.36451   109.66905  -139.85807
   44    43 S   CT   _C11    44     1.44143   110.63389    -1.23543
   45    44 S   HC   _H5_    45     1.09818   107.07091   -95.28776
   46    44 S   CT   _C12    46     1.53771   108.16730   145.26064
   47    46 S   HC   _H6_    47     1.10116   108.24039   -37.92311
   48    39 S   CT   _C8_    64     1.53412   111.77565   166.12319
   49    48 S   HC   _H3_    65     1.09896   109.14582    36.04062
   50    46 S   CM   _C16    48     1.52230   115.26544    80.02033
   51    50 S   CT   _C15    49     1.50286   110.70462   146.71587
   52    51 S   HC   _H16    50     1.09481   112.07506   123.39993
   53    51 S   HC   _H17    51     1.09445   110.37943  -115.43961
   54    50 S   CM   _C17    69     1.33965   127.20442   -31.88374
   55    54 S   HC   _H18    70     1.08352   122.14080    -1.21273
   56    54 S   HC   _H19    71     1.08539   120.80071   179.20475
   57    51 S   CT   _C14    52     1.52287   104.06833     3.78077
   58    57 S   HC   _H14    53     1.09870   108.93407    92.31969
   59    57 S   HC   _H15    54     1.09485   112.28647  -149.77931
   60    46 S   CT   _C13    55     1.54664   116.77544  -158.90501
   61    60 S   HC   _H7_    56     1.09935   108.76726    87.58114
   62    60 S   CM   _C5_    57     1.52179   115.05076   -31.64046
   63    62 S   CT   _C6_    58     1.51317   114.88699    84.57490
   64    63 S   HC   _H10    59     1.09756   109.24133    46.97127
   65    63 S   HC   _H11    60     1.09807   110.26049   162.01606
   66    62 S   CM   _C4_    66     1.34314   125.34997   -99.26148
   67    66 S   HC   _H8_    67     1.08231   122.72102     1.94983
   68    66 S   HC   _H9_    68     1.08577   121.11406  -178.24844
   69    63 S   CT   _C7_    61     1.52732   114.25521   -76.16968
   70    69 S   HC   _H12    62     1.09684   107.60512   178.85962
   71    69 S   HC   _H13    63     1.09806   109.23313   -66.49355
  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   7   5   4   3
  11   5   4   2   1   1  13   7   8   3   9  16   7  19   8  10
   4  12  11   6   5   4   1   1   7   4   3   9   3   9   8   5
   4   3   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    48  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    44    69    48    49  
   35    39    40    41    48  
   39    40    41    48  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    63    69    70    71    48    49  
   41    42    43    44    69    48    49  
   42    43    44    45    46    69    48    49  
   43    44    48  
   44    45    46    47    50    60    69    48    49  
   45    46    47    50    51    57    60    61    62    63    69    70    71    48    49    54  
   46    47    50    60    69    48    49  
   47    50    51    52    53    57    58    59    60    61    62    63    69    48    49    66    54    55    56  
   50    51    57    60    61    62    48    54  
   49    50    60    62    63    64    65    69    70    71  
   63    69    70    71  
   51    52    53    57    58    59    60    61    62    54    55    56  
   52    53    57    58    59    60    61    62    54    55    56  
   53    57    58    59    60    54  
   57    58    59    60    54  
   55    56    57    60  
   56  
    0  
   58    59    60    61    62    63    66  
   59    60    61    62  
   60    61    62  
   61    62    63    64    65    69    66    67    68  
   62    63    66  
   63    64    65    69    70    71    66    67    68  
   64    65    69    70    71    66    67    68  
   65    69    70    71    66  
   69    70    71    66  
   67    68    69  
   68  
    0  
   70    71  
   71  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   44   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   46   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   51   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   55   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   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   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   67   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   68   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   317.000  1.522
   39    48   268.000  1.529
   41    42   570.000  1.229
   41    43   214.000  1.327
   43    44   320.000  1.410
   44    45   340.000  1.090
   44    46   268.000  1.529
   44    48   268.000  1.529
   46    47   340.000  1.090
   46    50   317.000  1.510
   46    60   268.000  1.529
   50    51   317.000  1.510
   50    54   549.000  1.340
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    57   268.000  1.529
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   268.000  1.529
   60    61   340.000  1.090
   60    62   317.000  1.510
   62    63   317.000  1.510
   62    66   549.000  1.340
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    69   268.000  1.529
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    48   268.000  1.529
   48    49   340.000  1.090
   66    67   340.000  1.080
   66    68   340.000  1.080
   54    55   340.000  1.080
   54    56   340.000  1.080
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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    63.00000  111.10000
   33    39    48    58.35000  112.70000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    80.00000  120.40000
   39    41    43    81.00000  111.40000
   39    48    44    58.35000  112.70000
   39    48    69    58.35000  112.70000
   39    48    49    37.50000  110.70000
   41    39    40    35.00000  109.50000
   41    43    44    83.00000  116.90000
   43    41    42    83.00000  123.40000
   43    44    45    35.00000  109.50000
   43    44    46    50.00000  109.50000
   43    44    48    50.00000  109.50000
   44    46    47    37.50000  110.70000
   44    46    50    70.00000  112.02700
   44    46    60    58.35000  112.70000
   44    48    69    58.35000  112.70000
   44    48    49    37.50000  110.70000
   46    44    45    37.50000  110.70000
   46    50    51    65.00000  117.92700
   46    50    54    70.00000  124.00000
   46    60    57    58.35000  112.70000
   46    60    61    37.50000  110.70000
   46    60    62    70.00000  112.02700
   50    46    47    35.00000  109.50000
   50    51    52    35.00000  109.50000
   50    51    53    35.00000  109.50000
   50    51    57    70.00000  112.02700
   50    54    55    35.00000  120.00000
   50    54    56    35.00000  120.00000
   51    57    58    37.50000  110.70000
   51    57    59    37.50000  110.70000
   51    57    60    58.35000  112.70000
   53    51    52    33.00000  107.80000
   57    51    52    37.50000  110.70000
   57    51    53    37.50000  110.70000
   57    60    61    37.50000  110.70000
   57    60    62    70.00000  112.02700
   59    57    58    33.00000  107.80000
   60    46    47    37.50000  110.70000
   60    46    50    70.00000  112.02700
   60    57    58    37.50000  110.70000
   60    57    59    37.50000  110.70000
   60    62    63    65.00000  117.92700
   60    62    66    70.00000  124.00000
   62    60    61    35.00000  109.50000
   62    63    64    35.00000  109.50000
   62    63    65    35.00000  109.50000
   62    63    69    70.00000  112.02700
   62    66    67    35.00000  120.00000
   62    66    68    35.00000  120.00000
   63    69    70    37.50000  110.70000
   63    69    71    37.50000  110.70000
   63    69    48    58.35000  112.70000
   65    63    64    33.00000  107.80000
   69    63    64    37.50000  110.70000
   69    63    65    37.50000  110.70000
   69    48    49    37.50000  110.70000
   71    69    70    33.00000  107.80000
   48    39    40    37.50000  110.70000
   48    39    41    63.00000  111.10000
   48    44    45    37.50000  110.70000
   48    44    46    58.35000  112.70000
   48    69    70    37.50000  110.70000
   48    69    71    37.50000  110.70000
   66    62    63    70.00000  124.00000
   68    66    67    35.00000  117.00000
   54    50    51    70.00000  124.00000
   56    54    55    35.00000  117.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    35   0.32350  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    39    40   0.15000  1.0 3.0
   29    33    39    41   0.56750  1.0 1.0
   29    33    39    41  -0.07550 -1.0 2.0
   29    33    39    41   0.20000  1.0 3.0
   29    33    39    48   0.44750  1.0 1.0
   29    33    39    48  -0.17800 -1.0 2.0
   29    33    39    48   0.20200  1.0 3.0
   33    39    41    42   0.30150 -1.0 2.0
   33    39    41    43   0.36750  1.0 3.0
   33    39    48    44   0.56750  1.0 1.0
   33    39    48    44  -0.07550 -1.0 2.0
   33    39    48    44   0.20000  1.0 3.0
   33    39    48    69   0.56750  1.0 1.0
   33    39    48    69  -0.07550 -1.0 2.0
   33    39    48    69   0.20000  1.0 3.0
   33    39    48    49   0.15000  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41  -0.11250  1.0 3.0
   34    33    39    48   0.15000  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41  -0.11250  1.0 3.0
   35    33    39    48   0.15000  1.0 3.0
   39    41   -43    44   1.63150  1.0 1.0
   39    41   -43    44   2.92000 -1.0 2.0
   40    39    41    42   0.00000  1.0 1.0
   40    39    41    43   0.00000  1.0 1.0
   40    39    48    44   0.15000  1.0 3.0
   40    39    48    69   0.15000  1.0 3.0
   40    39    48    49   0.15000  1.0 3.0
   41    39   -48    44  -0.95700  1.0 1.0
   41    39   -48    44  -0.18200 -1.0 2.0
   41    39   -48    44   0.29450  1.0 3.0
   41    39    48    69  -0.95700  1.0 1.0
   41    39    48    69  -0.18200 -1.0 2.0
   41    39    48    69   0.29450  1.0 3.0
   41    39    48    49  -0.11250  1.0 3.0
   41    43    44    45   0.08050  1.0 3.0
   41    43    44    46  -0.25900  1.0 1.0
   41    43    44    46  -0.47000 -1.0 2.0
   41    43    44    46   0.11750  1.0 3.0
   41    43   -44    48  -0.25900  1.0 1.0
   41    43   -44    48  -0.47000 -1.0 2.0
   41    43   -44    48   0.11750  1.0 3.0
   42    41    43    44   3.00000 -1.0 2.0
   43    44    46    47   0.23400  1.0 3.0
   43    44    46    50   0.61850  1.0 1.0
   43    44    46    50  -0.22750 -1.0 2.0
   43    44    46    50   0.15300  1.0 3.0
   43    44    46    60   0.62750  1.0 1.0
   43    44    46    60  -0.30950 -1.0 2.0
   43    44    46    60   0.27300  1.0 3.0
   43    44   -48    39   0.62750  1.0 1.0
   43    44   -48    39  -0.30950 -1.0 2.0
   43    44   -48    39   0.27300  1.0 3.0
   43    44    48    69   0.62750  1.0 1.0
   43    44    48    69  -0.30950 -1.0 2.0
   43    44    48    69   0.27300  1.0 3.0
   43    44    48    49   0.23400  1.0 3.0
   44    46    50    51   0.46850  1.0 1.0
   44    46    50    51   0.08550 -1.0 2.0
   44    46    50    51   0.09800  1.0 3.0
   44    46    50    54   0.09850  1.0 1.0
   44    46    50    54   0.15250 -1.0 2.0
   44    46    50    54  -0.50650  1.0 3.0
   44    46    60    57   0.56750  1.0 1.0
   44    46    60    57  -0.07550 -1.0 2.0
   44    46    60    57   0.20000  1.0 3.0
   44    46    60    61   0.15000  1.0 3.0
   44    46    60    62   0.34400  1.0 1.0
   44    46    60    62   0.09450 -1.0 2.0
   44    46    60    62   0.11100  1.0 3.0
   45    44    46    47   0.15000  1.0 3.0
   45    44    46    50   0.15000  1.0 3.0
   45    44    46    60   0.15000  1.0 3.0
   45    44    48    39   0.15000  1.0 3.0
   45    44    48    69   0.15000  1.0 3.0
   45    44    48    49   0.15000  1.0 3.0
   46    44    48    39   0.56750  1.0 1.0
   46    44    48    39  -0.07550 -1.0 2.0
   46    44    48    39   0.20000  1.0 3.0
   46    44    48    69   0.56750  1.0 1.0
   46    44    48    69  -0.07550 -1.0 2.0
   46    44    48    69   0.20000  1.0 3.0
   46    44    48    49   0.15000  1.0 3.0
   46    50    51    52   0.34800  1.0 3.0
   46    50    51    53   0.34800  1.0 3.0
   46    50   -51    57   0.46850  1.0 1.0
   46    50   -51    57   0.08550 -1.0 2.0
   46    50   -51    57   0.09800  1.0 3.0
   46    50    54    55   7.00000 -1.0 2.0
   46    50    54    56   7.00000 -1.0 2.0
   46    60    62    63   0.46850  1.0 1.0
   46    60    62    63   0.08550 -1.0 2.0
   46    60    62    63   0.09800  1.0 3.0
   46    60    62    66   0.09850  1.0 1.0
   46    60    62    66   0.15250 -1.0 2.0
   46    60    62    66  -0.50650  1.0 3.0
   47    46    50    51   0.34800  1.0 3.0
   47    46    50    54   0.00000  1.0 1.0
   47    46    60    57   0.15000  1.0 3.0
   47    46    60    61   0.15000  1.0 3.0
   47    46    60    62   0.15000  1.0 3.0
   50    46   -60    57   0.34400  1.0 1.0
   50    46   -60    57   0.09450 -1.0 2.0
   50    46   -60    57   0.11100  1.0 3.0
   50    46    60    61   0.15000  1.0 3.0
   50    46    60    62   0.31000  1.0 1.0
   50    46    60    62   0.14700 -1.0 2.0
   50    46    60    62   0.07550  1.0 3.0
   50    51    57    58   0.15000  1.0 3.0
   50    51    57    59   0.15000  1.0 3.0
   50    51   -57    60   0.34400  1.0 1.0
   50    51   -57    60   0.09450 -1.0 2.0
   50    51   -57    60   0.11100  1.0 3.0
   51    50    54    55   7.00000 -1.0 2.0
   51    50    54    56   7.00000 -1.0 2.0
   51    57   -60    46   0.56750  1.0 1.0
   51    57   -60    46  -0.07550 -1.0 2.0
   51    57   -60    46   0.20000  1.0 3.0
   51    57    60    61   0.15000  1.0 3.0
   51    57    60    62   0.34400  1.0 1.0
   51    57    60    62   0.09450 -1.0 2.0
   51    57    60    62   0.11100  1.0 3.0
   52    51    57    58   0.15000  1.0 3.0
   52    51    57    59   0.15000  1.0 3.0
   52    51    57    60   0.15000  1.0 3.0
   53    51    57    58   0.15000  1.0 3.0
   53    51    57    59   0.15000  1.0 3.0
   53    51    57    60   0.15000  1.0 3.0
   57    60    62    63   0.46850  1.0 1.0
   57    60    62    63   0.08550 -1.0 2.0
   57    60    62    63   0.09800  1.0 3.0
   57    60    62    66   0.09850  1.0 1.0
   57    60    62    66   0.15250 -1.0 2.0
   57    60    62    66  -0.50650  1.0 3.0
   58    57    60    46   0.15000  1.0 3.0
   58    57    60    61   0.15000  1.0 3.0
   58    57    60    62   0.15000  1.0 3.0
   59    57    60    46   0.15000  1.0 3.0
   59    57    60    61   0.15000  1.0 3.0
   59    57    60    62   0.15000  1.0 3.0
   60    46   -50    51   0.46850  1.0 1.0
   60    46   -50    51   0.08550 -1.0 2.0
   60    46   -50    51   0.09800  1.0 3.0
   60    46    50    54   0.09850  1.0 1.0
   60    46    50    54   0.15250 -1.0 2.0
   60    46    50    54  -0.50650  1.0 3.0
   60    62    63    64   0.34800  1.0 3.0
   60    62    63    65   0.34800  1.0 3.0
   60    62    63    69   0.46850  1.0 1.0
   60    62    63    69   0.08550 -1.0 2.0
   60    62    63    69   0.09800  1.0 3.0
   60    62    66    67   7.00000 -1.0 2.0
   60    62    66    68   7.00000 -1.0 2.0
   61    60    62    63   0.34800  1.0 3.0
   61    60    62    66   0.00000  1.0 1.0
   62    63    69    70   0.15000  1.0 3.0
   62    63    69    71   0.15000  1.0 3.0
   62    63    69    48   0.34400  1.0 1.0
   62    63    69    48   0.09450 -1.0 2.0
   62    63    69    48   0.11100  1.0 3.0
   63    62    66    67   7.00000 -1.0 2.0
   63    62    66    68   7.00000 -1.0 2.0
   63    69    48    39   0.56750  1.0 1.0
   63    69    48    39  -0.07550 -1.0 2.0
   63    69    48    39   0.20000  1.0 3.0
   63    69    48    44   0.56750  1.0 1.0
   63    69    48    44  -0.07550 -1.0 2.0
   63    69    48    44   0.20000  1.0 3.0
   63    69    48    49   0.15000  1.0 3.0
   64    63    69    70   0.15000  1.0 3.0
   64    63    69    71   0.15000  1.0 3.0
   64    63    69    48   0.15000  1.0 3.0
   65    63    69    70   0.15000  1.0 3.0
   65    63    69    71   0.15000  1.0 3.0
   65    63    69    48   0.15000  1.0 3.0
   70    69    48    39   0.15000  1.0 3.0
   70    69    48    44   0.15000  1.0 3.0
   70    69    48    49   0.15000  1.0 3.0
   71    69    48    39   0.15000  1.0 3.0
   71    69    48    44   0.15000  1.0 3.0
   71    69    48    49   0.15000  1.0 3.0
   48    39    41    42   0.30150 -1.0 2.0
   48    39   -41    43   0.36750  1.0 3.0
   48    44    46    47   0.15000  1.0 3.0
   48    44    46    50   0.34400  1.0 1.0
   48    44    46    50   0.09450 -1.0 2.0
   48    44    46    50   0.11100  1.0 3.0
   48    44    46    60   0.56750  1.0 1.0
   48    44    46    60  -0.07550 -1.0 2.0
   48    44    46    60   0.20000  1.0 3.0
   66    62    63    64   0.00000  1.0 1.0
   66    62    63    65   0.00000  1.0 1.0
   66    62    63    69   0.09850  1.0 1.0
   66    62    63    69   0.15250 -1.0 2.0
   66    62    63    69  -0.50650  1.0 3.0
   54    50    51    52   0.00000  1.0 1.0
   54    50    51    53   0.00000  1.0 1.0
   54    50    51    57   0.09850  1.0 1.0
   54    50    51    57   0.15250 -1.0 2.0
   54    50    51    57  -0.50650  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
   37    30    36    38  10.50000 -1.0 2.0
   39    43    41    42  10.50000 -1.0 2.0
   46    51    50    54   1.10000 -1.0 2.0
   60    63    62    66   1.10000 -1.0 2.0
   67    68    66    62   1.10000 -1.0 2.0
   55    56    54    50   1.10000 -1.0 2.0
END
