* LIGAND DATABASE FILE (OPLS2005)
*
001      72    74    136    222     409
    1     0 S   NP   _N1_     1    29.28623    92.93688   -23.97855
    2     1 S   H    _HN1     2     1.02781   105.51073   -94.94304
    3     1 S   H    _H1_     3     1.02966    93.68682    15.19789
    4     1 S   H    _H2_     4     1.02833    15.72862   164.02820
    5     1 S   CT   _CA1     5     1.50119   124.56110   133.12847
    6     5 S   HC   _HA1     6     1.09578   105.24020    67.72044
    7     5 S   CO3  _C1_     7     1.53781   112.35429   -52.46924
    8     7 S   O2Z  _O11     8     1.26356   115.01248   -45.08548
    9     7 S   O2Z  _O12     9     1.26243   114.90843   134.08358
   10     5 S   CT   _CB1    10     1.53085   107.39714  -174.44367
   11    10 S   HC   HB11    11     1.09826   109.26520   -51.40032
   12    10 S   HC   HB12    12     1.09829   110.44325    65.09631
   13    10 S   CT   _CG1    13     1.53024   112.72209  -172.55294
   14    13 S   HC   HG11    14     1.09596   110.39758   -63.63860
   15    13 S   HC   HG12    15     1.09642   110.07450    55.62951
   16    13 S   C    _CD1    16     1.51777   112.19394   175.85253
   17    16 S   O    _OE1    17     1.22736   123.23432    -5.70523
   18    16 S   N    _N2_    18     1.38659   111.78795   174.84984
   19    18 S   H    _HN2    19     1.01580   119.07764     2.53636
   20    18 S   CT1  _CA2    20     1.46063   123.26889  -179.57022
   21    20 S   HC   _HA2    21     1.09617   109.28847     1.86645
   22    20 S   C    _C2_    22     1.53522   109.10795  -113.42926
   23    22 S   O    _O2_    23     1.23059   122.00778  -146.82337
   24    20 S   CT   _CB2    32     1.53399   111.72871   123.92481
   25    24 S   HC   HB21    33     1.09655   109.70938    63.88272
   26    24 S   HC   HB22    34     1.09583   110.66063  -178.88162
   27    22 S   N    _N3_    24     1.38437   113.70764    40.72416
   28    27 S   H    _HN3    25     1.01472   119.06395    -0.53155
   29    24 S   S    _SG2    35     1.82931   115.09965   -56.21422
   30    27 S   CT   _CA3    26     1.45453   123.42131   174.82146
   31    30 S   HC   HA31    27     1.09523   109.25128    24.76282
   32    30 S   HC   HA32    28     1.09495   107.13231   141.78750
   33    29 S   CT   _C12    36     1.82633    99.99156   -60.84542
   34    33 S   HC   _H13    37     1.09535   108.83057   -46.05972
   35    33 S   HC   _H14    38     1.09052   107.26089    71.19412
   36    30 S   CO3  _C3_    29     1.52932   113.05750   -98.70326
   37    36 S   O2Z  _O31    30     1.26406   115.39244   -44.67067
   38    36 S   O2Z  _O32    31     1.26352   114.99096   136.23027
   39    33 S   CT   _C10    39     1.52847   110.76912  -168.05951
   40    39 S   HC   _H5_    40     1.09700   112.61035   -39.16841
   41    39 S   CO4  _C11    41     1.52786   112.01966    83.89453
   42    41 S   O    _O33    42     1.22096   126.41474   -41.92797
   43    41 S   OS   _O34    43     1.37776   109.87271   138.12838
   44    43 S   CT   _C8_    44     1.42193   107.25023     9.24837
   45    44 S   HC   _H3_    45     1.09720   106.58378    84.59621
   46    44 S   CT   _C7_    46     1.51962   114.43174  -153.82203
   47    46 S   HC   _H11    47     1.09841   109.14495   -62.08988
   48    46 S   HC   _H12    48     1.09941   109.00280    52.28196
   49    39 S   CT   _C9_    61     1.52624   113.04390  -164.85246
   50    49 S   HC   _H4_    62     1.10185   107.33163   -40.53227
   51    46 S   CT   _C6_    49     1.55946   111.91185   174.60123
   52    51 S   CT   _C18    50     1.54170   109.80567    69.69292
   53    52 S   HC   _H17    51     1.09389   112.95451   -55.01989
   54    52 S   HC   _H18    52     1.09691   110.92819    63.94484
   55    51 S   CM   _C5_    68     1.53253   105.75904  -174.50802
   56    55 S   HC   _H10    69     1.09074   115.30083   -66.04581
   57    52 S   OS   _O36    53     1.44199   113.52906  -175.98444
   58    55 S   CM   _C4_    70     1.33902   128.57282   112.79819
   59    58 S   HC   _H8_    71     1.08564   119.92761  -179.52358
   60    58 S   HC   _H9_    72     1.08245   123.14169    -0.00000
   61    57 S   CO4  _C17    54     1.35402   123.85836    37.77270
   62    61 S   O    _O35    55     1.22696   120.75557   168.72534
   63    61 S   CM   _C15    56     1.48204   116.64604   -13.35165
   64    51 S   CT   _C14    57     1.56269   111.30363   -48.57522
   65    64 S   HC   _H7_    58     1.10050   107.95605   -70.74309
   66    63 S   CM   _C16    65     1.34415   116.60645  -165.54054
   67    66 S   HC   _H15    66     1.08561   120.90650   178.25079
   68    66 S   HC   _H16    67     1.08531   122.76898    -1.72544
   69    64 S   CT   _C13    59     1.56312   113.50489    46.31261
   70    69 S   HC   _H6_    60     1.09606   110.84045    69.24985
   71    69 S   OH   _O37    63     1.42463   110.17550  -172.76660
   72    71 S   HO   _H19    64     0.97247   108.48252    58.57445
  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  13   7  16   6   5
   9   4  17  12   5   4   9   4   5   3   1   1   8   3   8   8
   4   3   1   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    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    49  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    44    69    49    50  
   35    39    40    41    49  
   39    40    41    49  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    64    69    70    49    50    71  
   41    42    43    44    69    49    50  
   42    43    44    45    46    69    49    50  
   43    44    49  
   44    45    46    47    48    51    69    49    50  
   45    46    47    48    51    52    64    69    70    49    50    71    55  
   46    47    48    51    69    49    50  
   47    48    51    52    53    54    57    63    64    65    69    49    50    55    56    58  
   48    51    52    64    49    55  
   51    52    64    49    55  
   50    71    72    51    63    64    65    69    70  
   71    64    69    70  
   52    53    54    57    61    63    64    65    69    70    71    66    55    56    58    59    60  
   53    54    57    61    62    63    64    65    69    55    56    58  
   54    57    61    64    55  
   57    61    64    55  
   56    58    59    60    57    63    64    65    69  
   58    59    60    64  
   61    62    63    64    66  
   59    60    64  
   60  
    0  
   62    63    64    65    69    66    67    68  
   63    64    66  
   64    65    69    70    71    66    67    68  
   65    69    70    71    72    66    67    68  
   69    70    71    66  
   67    68    69  
   68  
    0  
   70    71    72  
   71    72  
   72  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   52   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   54   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   55   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   58   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   59   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   60   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   61   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   62   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   63   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   64   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   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   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   72   0.5000   0.0300   0.418000   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    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    49   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    49   268.000  1.529
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    51   268.000  1.529
   51    52   268.000  1.529
   51    64   268.000  1.529
   51    55   317.000  1.510
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    57   320.000  1.410
   57    61   214.000  1.327
   61    62   570.000  1.229
   61    63   320.000  1.462
   63    64   317.000  1.510
   63    66   549.000  1.340
   64    65   340.000  1.090
   64    69   268.000  1.529
   69    70   340.000  1.090
   69    49   268.000  1.529
   69    71   320.000  1.410
   49    50   340.000  1.090
   71    72   553.000  0.945
   66    67   340.000  1.080
   66    68   340.000  1.080
   55    56   340.000  1.080
   55    58   549.000  1.340
   58    59   340.000  1.080
   58    60   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    49    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    49    44    58.35000  112.70000
   39    49    69    58.35000  112.70000
   39    49    50    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    49    50.00000  109.50000
   44    46    47    37.50000  110.70000
   44    46    48    37.50000  110.70000
   44    46    51    58.35000  112.70000
   44    49    69    58.35000  112.70000
   44    49    50    37.50000  110.70000
   46    44    45    37.50000  110.70000
   46    51    52    58.35000  112.70000
   46    51    64    58.35000  112.70000
   46    51    55    70.00000  112.02700
   48    46    47    33.00000  107.80000
   51    46    47    37.50000  110.70000
   51    46    48    37.50000  110.70000
   51    52    53    37.50000  110.70000
   51    52    54    37.50000  110.70000
   51    52    57    50.00000  109.50000
   51    64    63    70.00000  112.02700
   51    64    65    37.50000  110.70000
   51    64    69    58.35000  112.70000
   51    55    56    35.00000  117.00000
   51    55    58    70.00000  124.00000
   52    57    61    83.00000  116.90000
   54    52    53    33.00000  107.80000
   57    52    53    35.00000  109.50000
   57    52    54    35.00000  109.50000
   57    61    62    83.00000  123.40000
   57    61    63    90.00000  111.29400
   61    63    64    65.00000  116.34900
   61    63    66    65.00000  118.96000
   63    61    62    80.00000  123.72100
   63    64    65    35.00000  109.50000
   63    64    69    70.00000  112.02700
   63    66    67    35.00000  120.00000
   63    66    68    35.00000  120.00000
   64    51    52    58.35000  112.70000
   64    69    70    37.50000  110.70000
   64    69    49    58.35000  112.70000
   64    69    71    50.00000  109.50000
   69    64    65    37.50000  110.70000
   69    49    50    37.50000  110.70000
   69    71    72    55.00000  108.50000
   49    39    40    37.50000  110.70000
   49    39    41    63.00000  111.10000
   49    44    45    37.50000  110.70000
   49    44    46    58.35000  112.70000
   49    69    70    37.50000  110.70000
   71    69    70    35.00000  109.50000
   71    69    49    50.00000  109.50000
   66    63    64    70.00000  124.00000
   68    66    67    35.00000  117.00000
   55    51    52    70.00000  112.02700
   55    51    64    70.00000  112.02700
   55    58    59    35.00000  120.00000
   55    58    60    35.00000  120.00000
   58    55    56    35.00000  120.00000
   60    58    59    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    49   0.44750  1.0 1.0
   29    33    39    49  -0.17800 -1.0 2.0
   29    33    39    49   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    49    44   0.56750  1.0 1.0
   33    39    49    44  -0.07550 -1.0 2.0
   33    39    49    44   0.20000  1.0 3.0
   33    39    49    69   0.56750  1.0 1.0
   33    39    49    69  -0.07550 -1.0 2.0
   33    39    49    69   0.20000  1.0 3.0
   33    39    49    50   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    49   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    49   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    49    44   0.15000  1.0 3.0
   40    39    49    69   0.15000  1.0 3.0
   40    39    49    50   0.15000  1.0 3.0
   41    39   -49    44  -0.95700  1.0 1.0
   41    39   -49    44  -0.18200 -1.0 2.0
   41    39   -49    44   0.29450  1.0 3.0
   41    39    49    69  -0.95700  1.0 1.0
   41    39    49    69  -0.18200 -1.0 2.0
   41    39    49    69   0.29450  1.0 3.0
   41    39    49    50  -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    49  -0.25900  1.0 1.0
   41    43   -44    49  -0.47000 -1.0 2.0
   41    43   -44    49   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    48   0.23400  1.0 3.0
   43    44    46    51   0.62750  1.0 1.0
   43    44    46    51  -0.30950 -1.0 2.0
   43    44    46    51   0.27300  1.0 3.0
   43    44   -49    39   0.62750  1.0 1.0
   43    44   -49    39  -0.30950 -1.0 2.0
   43    44   -49    39   0.27300  1.0 3.0
   43    44    49    69   0.62750  1.0 1.0
   43    44    49    69  -0.30950 -1.0 2.0
   43    44    49    69   0.27300  1.0 3.0
   43    44    49    50   0.23400  1.0 3.0
   44    46    51    52   0.56750  1.0 1.0
   44    46    51    52  -0.07550 -1.0 2.0
   44    46    51    52   0.20000  1.0 3.0
   44    46    51    64   0.56750  1.0 1.0
   44    46    51    64  -0.07550 -1.0 2.0
   44    46    51    64   0.20000  1.0 3.0
   44    46    51    55   0.34400  1.0 1.0
   44    46    51    55   0.09450 -1.0 2.0
   44    46    51    55   0.11100  1.0 3.0
   45    44    46    47   0.15000  1.0 3.0
   45    44    46    48   0.15000  1.0 3.0
   45    44    46    51   0.15000  1.0 3.0
   45    44    49    39   0.15000  1.0 3.0
   45    44    49    69   0.15000  1.0 3.0
   45    44    49    50   0.15000  1.0 3.0
   46    44    49    39   0.56750  1.0 1.0
   46    44    49    39  -0.07550 -1.0 2.0
   46    44    49    39   0.20000  1.0 3.0
   46    44    49    69   0.56750  1.0 1.0
   46    44    49    69  -0.07550 -1.0 2.0
   46    44    49    69   0.20000  1.0 3.0
   46    44    49    50   0.15000  1.0 3.0
   46    51    52    53   0.15000  1.0 3.0
   46    51    52    54   0.15000  1.0 3.0
   46    51    52    57   0.62750  1.0 1.0
   46    51    52    57  -0.30950 -1.0 2.0
   46    51    52    57   0.27300  1.0 3.0
   46    51    64    63   0.34400  1.0 1.0
   46    51    64    63   0.09450 -1.0 2.0
   46    51    64    63   0.11100  1.0 3.0
   46    51    64    65   0.15000  1.0 3.0
   46    51   -64    69   0.56750  1.0 1.0
   46    51   -64    69  -0.07550 -1.0 2.0
   46    51   -64    69   0.20000  1.0 3.0
   46    51    55    56   0.00000  1.0 1.0
   46    51    55    58   0.09850  1.0 1.0
   46    51    55    58   0.15250 -1.0 2.0
   46    51    55    58  -0.50650  1.0 3.0
   47    46    51    52   0.15000  1.0 3.0
   47    46    51    64   0.15000  1.0 3.0
   47    46    51    55   0.15000  1.0 3.0
   48    46    51    52   0.15000  1.0 3.0
   48    46    51    64   0.15000  1.0 3.0
   48    46    51    55   0.15000  1.0 3.0
   51    52    57    61  -0.25900  1.0 1.0
   51    52    57    61  -0.47000 -1.0 2.0
   51    52    57    61   0.11750  1.0 3.0
   51    64    69    70   0.15000  1.0 3.0
   51    64    69    49   0.56750  1.0 1.0
   51    64    69    49  -0.07550 -1.0 2.0
   51    64    69    49   0.20000  1.0 3.0
   51    64    69    71   0.86500  1.0 1.0
   51    64    69    71  -0.17500 -1.0 2.0
   51    64    69    71   0.20800  1.0 3.0
   51    55    58    59   7.00000 -1.0 2.0
   51    55    58    60   7.00000 -1.0 2.0
   52    51    64    63   0.34400  1.0 1.0
   52    51    64    63   0.09450 -1.0 2.0
   52    51    64    63   0.11100  1.0 3.0
   52    51    64    65   0.15000  1.0 3.0
   52    51    64    69   0.56750  1.0 1.0
   52    51    64    69  -0.07550 -1.0 2.0
   52    51    64    69   0.20000  1.0 3.0
   52    51    55    56   0.00000  1.0 1.0
   52    51    55    58   0.09850  1.0 1.0
   52    51    55    58   0.15250 -1.0 2.0
   52    51    55    58  -0.50650  1.0 3.0
   52    57    61    62   3.00000 -1.0 2.0
   52    57   -61    63   2.00000 -1.0 2.0
   53    52    57    61   0.08050  1.0 3.0
   54    52    57    61   0.08050  1.0 3.0
   57    61    63    64  -0.15000  1.0 1.0
   57    61    63    64   0.89550 -1.0 2.0
   57    61    63    64  -0.06900  1.0 3.0
   57    61    63    66  -0.56150  1.0 1.0
   57    61    63    66   2.19150 -1.0 2.0
   61    63   -64    51   0.09700  1.0 1.0
   61    63   -64    51   0.15600 -1.0 2.0
   61    63   -64    51  -0.50800  1.0 3.0
   61    63    64    65   0.15000  1.0 3.0
   61    63    64    69   0.09700  1.0 1.0
   61    63    64    69   0.15600 -1.0 2.0
   61    63    64    69  -0.50800  1.0 3.0
   61    63    66    67   7.00000 -1.0 2.0
   61    63    66    68   7.00000 -1.0 2.0
   62    61    63    64  -0.64400  1.0 1.0
   62    61    63    64   0.26850 -1.0 2.0
   62    61    63    66   1.00000 -1.0 2.0
   63    64    69    70   0.15000  1.0 3.0
   63    64    69    49   0.34400  1.0 1.0
   63    64    69    49   0.09450 -1.0 2.0
   63    64    69    49   0.11100  1.0 3.0
   63    64    69    71   1.05650  1.0 1.0
   63    64    69    71   0.15600 -1.0 2.0
   63    64    69    71   0.53150  1.0 3.0
   64    51    52    53   0.15000  1.0 3.0
   64    51    52    54   0.15000  1.0 3.0
   64    51   -52    57   0.62750  1.0 1.0
   64    51   -52    57  -0.30950 -1.0 2.0
   64    51   -52    57   0.27300  1.0 3.0
   64    51    55    56   0.00000  1.0 1.0
   64    51    55    58   0.09850  1.0 1.0
   64    51    55    58   0.15250 -1.0 2.0
   64    51    55    58  -0.50650  1.0 3.0
   64    63    66    67   7.00000 -1.0 2.0
   64    63    66    68   7.00000 -1.0 2.0
   64    69    49    39   0.56750  1.0 1.0
   64    69    49    39  -0.07550 -1.0 2.0
   64    69    49    39   0.20000  1.0 3.0
   64    69   -49    44   0.56750  1.0 1.0
   64    69   -49    44  -0.07550 -1.0 2.0
   64    69   -49    44   0.20000  1.0 3.0
   64    69    49    50   0.15000  1.0 3.0
   64    69    71    72  -0.11600  1.0 1.0
   64    69    71    72  -0.09450 -1.0 2.0
   64    69    71    72   0.21250  1.0 3.0
   65    64    69    70   0.15000  1.0 3.0
   65    64    69    49   0.15000  1.0 3.0
   65    64    69    71   0.23400  1.0 3.0
   70    69    49    39   0.15000  1.0 3.0
   70    69    49    44   0.15000  1.0 3.0
   70    69    49    50   0.15000  1.0 3.0
   70    69    71    72   0.19450  1.0 3.0
   49    39    41    42   0.30150 -1.0 2.0
   49    39   -41    43   0.36750  1.0 3.0
   49    44    46    47   0.15000  1.0 3.0
   49    44    46    48   0.15000  1.0 3.0
   49    44   -46    51   0.56750  1.0 1.0
   49    44   -46    51  -0.07550 -1.0 2.0
   49    44   -46    51   0.20000  1.0 3.0
   49    69    71    72  -0.11600  1.0 1.0
   49    69    71    72  -0.09450 -1.0 2.0
   49    69    71    72   0.21250  1.0 3.0
   71    69    49    39   0.86500  1.0 1.0
   71    69    49    39  -0.17500 -1.0 2.0
   71    69    49    39   0.20800  1.0 3.0
   71    69    49    44   0.86500  1.0 1.0
   71    69    49    44  -0.17500 -1.0 2.0
   71    69    49    44   0.20800  1.0 3.0
   71    69    49    50   0.23400  1.0 3.0
   66    63    64    51   0.09850  1.0 1.0
   66    63    64    51   0.15250 -1.0 2.0
   66    63    64    51  -0.50650  1.0 3.0
   66    63    64    65   0.00000  1.0 1.0
   66    63    64    69   0.09850  1.0 1.0
   66    63    64    69   0.15250 -1.0 2.0
   66    63    64    69  -0.50650  1.0 3.0
   55    51    52    53   0.15000  1.0 3.0
   55    51    52    54   0.15000  1.0 3.0
   55    51    52    57   0.61850  1.0 1.0
   55    51    52    57  -0.22750 -1.0 2.0
   55    51    52    57   0.15300  1.0 3.0
   55    51    64    63   0.31000  1.0 1.0
   55    51    64    63   0.14700 -1.0 2.0
   55    51    64    63   0.07550  1.0 3.0
   55    51    64    65   0.15000  1.0 3.0
   55    51    64    69   0.34400  1.0 1.0
   55    51    64    69   0.09450 -1.0 2.0
   55    51    64    69   0.11100  1.0 3.0
   56    55    58    59   7.00000 -1.0 2.0
   56    55    58    60   7.00000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   37    30    36    38  10.50000 -1.0 2.0
   39    43    41    42  10.50000 -1.0 2.0
   57    63    61    62  10.50000 -1.0 2.0
   61    64    63    66   1.10000 -1.0 2.0
   67    68    66    63   1.10000 -1.0 2.0
   51    56    55    58  15.00000 -1.0 2.0
   59    60    58    55  15.00000 -1.0 2.0
END
