* LIGAND DATABASE FILE (OPLS2005)
*
001      74    75    140    218     418
    1     0 S   NP   _N1_     1    28.87077    96.80887   -24.84764
    2     1 S   H    _HN1     2     1.02946    67.35225     2.66396
    3     1 S   H    _H1_     3     1.02824    39.78432   179.90109
    4     1 S   H    _H2_     4     1.02804   118.81072   -96.57534
    5     1 S   CT   _CA1     5     1.50135   126.81442   101.87321
    6     5 S   HC   _HA1     6     1.09574   105.13669   101.31049
    7     5 S   CO3  _C1_     7     1.53750   112.49788   -18.90282
    8     7 S   O2Z  _O11     8     1.26383   114.99817   -41.90792
    9     7 S   O2Z  _O12     9     1.26231   114.93523   137.03587
   10     5 S   CT   _CB1    10     1.53036   107.39633  -140.70155
   11    10 S   HC   HB11    11     1.09854   109.30679   -48.90183
   12    10 S   HC   HB12    12     1.09812   110.48268    67.66813
   13    10 S   CT   _CG1    13     1.53068   112.69197  -169.79853
   14    13 S   HC   HG11    14     1.09555   110.86098   -69.08047
   15    13 S   HC   HG12    15     1.09661   109.61829    50.19194
   16    13 S   C    _CD1    16     1.51811   111.59386   170.80463
   17    16 S   O    _OE1    17     1.22787   123.00040    19.63167
   18    16 S   N    _N2_    18     1.38623   112.09177  -160.39506
   19    18 S   H    _HN2    19     1.01572   119.04354     0.41117
   20    18 S   CT1  _CA2    20     1.46216   123.26422   175.22562
   21    20 S   HC   _HA2    21     1.09741   109.31168     9.39666
   22    20 S   C    _C2_    22     1.53763   108.86428  -106.11419
   23    22 S   O    _O2_    23     1.23094   122.19681  -148.74791
   24    20 S   CT   _CB2    32     1.53433   111.70610   131.52037
   25    24 S   HC   HB21    33     1.09176   109.57234    57.71547
   26    24 S   HC   HB22    34     1.09306   109.28297   175.79453
   27    22 S   N    _N3_    24     1.38291   113.91245    38.69216
   28    27 S   H    _HN3    25     1.01523   119.63441    -2.96913
   29    24 S   S    _SG2    35     1.82798   111.21467   -64.68223
   30    27 S   CT   _CA3    26     1.45284   123.39198   177.36285
   31    30 S   HC   HA31    27     1.09542   107.48570   -65.72784
   32    30 S   HC   HA32    28     1.09551   108.04840    50.76711
   33    29 S   CT   _C15    36     1.87808   102.98964   168.90389
   34    30 S   CO3  _C3_    29     1.53008   113.96430   172.77575
   35    34 S   O2Z  _O31    30     1.26400   116.06542    -0.79844
   36    34 S   O2Z  _O32    31     1.26419   114.42743   179.26832
   37    33 S   CM   _C4_    37     1.53895   106.48258   -86.75595
   38    33 S   CT   _C14    55     1.56120   114.26756    39.51582
   39    38 S   HC   _H30    56     1.09516   107.92706   -61.09611
   40    37 S   CMA  _C5_    38     1.35010   113.05679   -96.69979
   41    40 S   OM   _O16    39     1.25742   135.56001   179.63955
   42    38 S   OH   _O17    57     1.43882   110.07153  -173.72052
   43    42 S   HO   _H40    58     0.96978   109.19889   -81.83506
   44    37 S   CT   _C16    71     1.49876   122.88587    83.65049
   45    44 S   HC   _H31    72     1.09233   110.88639   -71.92049
   46    44 S   HC   _H32    73     1.09535   111.94661   168.84770
   47    44 S   HC   _H33    74     1.09307   111.45016    49.67561
   48    40 S   CT   _C8_    40     1.50704   109.90311     0.24629
   49    48 S   HC   _H21    41     1.09760   110.79943   100.57052
   50    48 S   HC   _H22    42     1.09753   112.55481  -137.63502
   51    33 S   CT   _C12    43     1.56529   110.80034   166.13037
   52    51 S   HC   _H28    44     1.09990   108.11029  -165.78892
   53    51 S   CT   _C13    45     1.54639   119.41434   -44.15457
   54    53 S   HC   _H29    46     1.09836   109.05590    76.18727
   55    53 S   CT   _C10    47     1.53832   115.34183   -43.98402
   56    55 S   HC   _H25    48     1.09838   108.79286  -156.44683
   57    55 S   HC   _H26    49     1.09632   109.53301    90.32352
   58    53 S   CT   _C18    67     1.53993   110.14379  -168.22912
   59    58 S   HC   _H37    68     1.09514   111.30191    62.44332
   60    58 S   HC   _H38    69     1.09416   111.46918   -58.44629
   61    58 S   HC   _H39    70     1.09558   110.84857  -177.40188
   62    55 S   CT   _C9_    50     1.52980   116.25538   -34.31969
   63    62 S   HC   _H23    51     1.09904   106.07615  -155.36931
   64    62 S   HC   _H24    52     1.09498   110.76542   -40.83617
   65    62 S   CT   _C11    53     1.54805   113.13604    86.40680
   66    65 S   HC   _H27    54     1.09721   105.30949    43.67780
   67    65 S   CM   _C7_    59     1.53669   112.88075   157.66049
   68    67 S   CM   _C6_    60     1.34394   124.28390    30.37849
   69    68 S   HC   _H19    61     1.08541   121.27880  -179.66023
   70    68 S   HC   _H20    62     1.08396   122.14315     1.20106
   71    67 S   CT   _C17    63     1.50733   115.67991  -148.94118
   72    71 S   HC   _H34    64     1.09408   110.77104   -61.73047
   73    71 S   HC   _H35    65     1.09493   110.26505    58.42441
   74    71 S   HC   _H36    66     1.09531   112.18168   178.17265
  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  16  18   7  11   5   6   1   5   2   1   1   8
   4   3  12   4  12   8  12   6   5   4   2   1   1   7   4   3
   9   3   7   6   2   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    51    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    48    51    52    53    65    38    39    42    44  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    41    48    49    50    51    52    53    54    55    62    65    66    38    39    42    43    67    58    44    45    46    47  
   35    36  
   36  
    0  
   40    41    48    49    50    51    52    53    65    38    39    42    44    45    46    47  
   39    42    43    67    68    71    44    40    48    51    52    53    55    62    63    64    65    66  
   42    43    67    51    62    65    66  
   41    48    49    50    51    52    53    44    45    46    47  
   48    49    50    51    44  
   43    67    51    62    65    66  
   65  
   45    46    47    48    51  
   46    47  
   47  
    0  
   49    50    51    52    53    54    55    58  
   50    51    52    53  
   51    52    53  
   52    53    54    55    56    57    62    65    58    59    60    61  
   53    54    55    58  
   54    55    56    57    62    63    64    65    58    59    60    61  
   55    56    57    62    58    59    60    61  
   56    57    62    63    64    65    66    67    58    59    60    61  
   57    62    63    64    65    58  
   62    63    64    65    58  
   59    60    61    62  
   60    61  
   61  
    0  
   63    64    65    66    67    68    71  
   64    65    66    67  
   65    66    67  
   66    67    68    69    70    71    72    73    74  
   67    68    71  
   68    69    70    71    72    73    74  
   69    70    71    72    73    74  
   70    71  
   71  
   72    73    74  
   73    74  
   74  
    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   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   43   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   44   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   68   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   69   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   70   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660  -0.180000   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
   74   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    51   268.000  1.529
   33    38   268.000  1.529
   37    40   465.000  1.376
   37    44   317.000  1.510
   40    41   745.000  1.250
   40    48   270.000  1.512
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   268.000  1.529
   51    52   340.000  1.090
   51    53   268.000  1.529
   53    54   340.000  1.090
   53    55   268.000  1.529
   53    58   268.000  1.529
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    62   268.000  1.529
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   268.000  1.529
   65    66   340.000  1.090
   65    38   268.000  1.529
   65    67   317.000  1.510
   38    39   340.000  1.090
   38    42   320.000  1.410
   42    43   553.000  0.945
   67    68   549.000  1.340
   67    71   317.000  1.510
   68    69   340.000  1.080
   68    70   340.000  1.080
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   340.000  1.090
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   340.000  1.090
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   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    51    75.00000  111.63000
   29    33    38    75.00000  111.63000
   33    37    40    70.00000  124.00000
   33    37    44    65.00000  117.92700
   33    51    48    58.35000  112.70000
   33    51    52    37.50000  110.70000
   33    51    53    58.35000  112.70000
   33    38    65    58.35000  112.70000
   33    38    39    37.50000  110.70000
   33    38    42    50.00000  109.50000
   37    40    41    65.00000  137.10300
   37    40    48    65.00000  122.18000
   37    44    45    35.00000  109.50000
   37    44    46    35.00000  109.50000
   37    44    47    35.00000  109.50000
   40    48    49    45.00000  110.52000
   40    48    50    45.00000  110.52000
   40    48    51    70.00000  112.02700
   48    40    41    85.00000  112.85300
   48    51    52    37.50000  110.70000
   48    51    53    58.35000  112.70000
   50    48    49    33.00000  107.80000
   51    33    37    70.00000  112.02700
   51    48    49    37.50000  110.70000
   51    48    50    37.50000  110.70000
   51    53    54    37.50000  110.70000
   51    53    55    58.35000  112.70000
   51    53    58    58.35000  112.70000
   53    51    52    37.50000  110.70000
   53    55    56    37.50000  110.70000
   53    55    57    37.50000  110.70000
   53    55    62    58.35000  112.70000
   53    58    59    37.50000  110.70000
   53    58    60    37.50000  110.70000
   53    58    61    37.50000  110.70000
   55    53    54    37.50000  110.70000
   55    62    63    37.50000  110.70000
   55    62    64    37.50000  110.70000
   55    62    65    58.35000  112.70000
   57    55    56    33.00000  107.80000
   62    55    56    37.50000  110.70000
   62    55    57    37.50000  110.70000
   62    65    66    37.50000  110.70000
   62    65    38    58.35000  112.70000
   62    65    67    70.00000  112.02700
   64    62    63    33.00000  107.80000
   65    62    63    37.50000  110.70000
   65    62    64    37.50000  110.70000
   65    38    39    37.50000  110.70000
   65    38    42    50.00000  109.50000
   65    67    68    70.00000  124.00000
   65    67    71    65.00000  117.92700
   38    33    37    70.00000  112.02700
   38    33    51    58.35000  112.70000
   38    65    66    37.50000  110.70000
   38    42    43    55.00000  108.50000
   42    38    39    35.00000  109.50000
   67    65    66    35.00000  109.50000
   67    65    38    70.00000  112.02700
   67    68    69    35.00000  120.00000
   67    68    70    35.00000  120.00000
   67    71    72    35.00000  109.50000
   67    71    73    35.00000  109.50000
   67    71    74    35.00000  109.50000
   70    68    69    35.00000  117.00000
   71    67    68    70.00000  124.00000
   73    71    72    33.00000  107.80000
   74    71    72    33.00000  107.80000
   74    71    73    33.00000  107.80000
   58    53    54    37.50000  110.70000
   58    53    55    58.35000  112.70000
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    33.00000  107.80000
   44    37    40    70.00000  124.00000
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    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    51   0.01700  1.0 1.0
   24    29    33    51  -0.23550 -1.0 2.0
   24    29    33    51   0.21350  1.0 3.0
   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
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    40   0.42700  1.0 1.0
   29    33    37    40  -0.70350 -1.0 2.0
   29    33    37    40  -0.43150  1.0 3.0
   29    33    37    44   0.30250  1.0 1.0
   29    33    37    44  -0.14950 -1.0 2.0
   29    33    37    44   0.36900  1.0 3.0
   29    33    51    48   0.44750  1.0 1.0
   29    33    51    48  -0.17800 -1.0 2.0
   29    33    51    48   0.20200  1.0 3.0
   29    33    51    52   0.15000  1.0 3.0
   29    33    51    53   0.44750  1.0 1.0
   29    33    51    53  -0.17800 -1.0 2.0
   29    33    51    53   0.20200  1.0 3.0
   29    33    38    65   0.44750  1.0 1.0
   29    33    38    65  -0.17800 -1.0 2.0
   29    33    38    65   0.20200  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    42   0.56750  1.0 1.0
   29    33    38    42  -0.07550 -1.0 2.0
   29    33    38    42   0.20000  1.0 3.0
   33    37    40    41   7.00000 -1.0 2.0
   33    37   -40    48   7.00000 -1.0 2.0
   33    37    44    45   0.34800  1.0 3.0
   33    37    44    46   0.34800  1.0 3.0
   33    37    44    47   0.34800  1.0 3.0
   33    51    53    54   0.15000  1.0 3.0
   33    51    53    55   0.56750  1.0 1.0
   33    51    53    55  -0.07550 -1.0 2.0
   33    51    53    55   0.20000  1.0 3.0
   33    51    53    58   0.56750  1.0 1.0
   33    51    53    58  -0.07550 -1.0 2.0
   33    51    53    58   0.20000  1.0 3.0
   33    38    42    43  -0.11600  1.0 1.0
   33    38    42    43  -0.09450 -1.0 2.0
   33    38    42    43   0.21250  1.0 3.0
   37    33   -51    48   0.34400  1.0 1.0
   37    33   -51    48   0.09450 -1.0 2.0
   37    33   -51    48   0.11100  1.0 3.0
   37    33    51    52   0.15000  1.0 3.0
   37    33    51    53   0.34400  1.0 1.0
   37    33    51    53   0.09450 -1.0 2.0
   37    33    51    53   0.11100  1.0 3.0
   37    33    38    65   0.34400  1.0 1.0
   37    33    38    65   0.09450 -1.0 2.0
   37    33    38    65   0.11100  1.0 3.0
   37    33    38    39   0.15000  1.0 3.0
   37    33    38    42   1.05650  1.0 1.0
   37    33    38    42   0.15600 -1.0 2.0
   37    33    38    42   0.53150  1.0 3.0
   37    40    48    49   0.00000  1.0 1.0
   37    40    48    50   0.00000  1.0 1.0
   37    40   -48    51   0.09850  1.0 1.0
   37    40   -48    51   0.15250 -1.0 2.0
   37    40   -48    51  -0.50650  1.0 3.0
   40    37    44    45   0.00000  1.0 1.0
   40    37    44    46   0.00000  1.0 1.0
   40    37    44    47   0.00000  1.0 1.0
   40    48   -51    33   0.34400  1.0 1.0
   40    48   -51    33   0.09450 -1.0 2.0
   40    48   -51    33   0.11100  1.0 3.0
   40    48    51    52   0.15000  1.0 3.0
   40    48    51    53   0.34400  1.0 1.0
   40    48    51    53   0.09450 -1.0 2.0
   40    48    51    53   0.11100  1.0 3.0
   41    40    48    49   0.00000  1.0 1.0
   41    40    48    50   0.00000  1.0 1.0
   41    40    48    51   0.09700  1.0 1.0
   41    40    48    51   0.15600 -1.0 2.0
   41    40    48    51  -0.50800  1.0 3.0
   48    51    53    54   0.15000  1.0 3.0
   48    51    53    55   0.56750  1.0 1.0
   48    51    53    55  -0.07550 -1.0 2.0
   48    51    53    55   0.20000  1.0 3.0
   48    51    53    58   0.56750  1.0 1.0
   48    51    53    58  -0.07550 -1.0 2.0
   48    51    53    58   0.20000  1.0 3.0
   49    48    51    33   0.15000  1.0 3.0
   49    48    51    52   0.15000  1.0 3.0
   49    48    51    53   0.15000  1.0 3.0
   50    48    51    33   0.15000  1.0 3.0
   50    48    51    52   0.15000  1.0 3.0
   50    48    51    53   0.15000  1.0 3.0
   51    33   -37    40   0.09850  1.0 1.0
   51    33   -37    40   0.15250 -1.0 2.0
   51    33   -37    40  -0.50650  1.0 3.0
   51    33    37    44   0.46850  1.0 1.0
   51    33    37    44   0.08550 -1.0 2.0
   51    33    37    44   0.09800  1.0 3.0
   51    33    38    65   0.56750  1.0 1.0
   51    33    38    65  -0.07550 -1.0 2.0
   51    33    38    65   0.20000  1.0 3.0
   51    33    38    39   0.15000  1.0 3.0
   51    33    38    42   0.86500  1.0 1.0
   51    33    38    42  -0.17500 -1.0 2.0
   51    33    38    42   0.20800  1.0 3.0
   51    53    55    56   0.15000  1.0 3.0
   51    53    55    57   0.15000  1.0 3.0
   51    53    55    62   0.56750  1.0 1.0
   51    53    55    62  -0.07550 -1.0 2.0
   51    53    55    62   0.20000  1.0 3.0
   51    53    58    59   0.15000  1.0 3.0
   51    53    58    60   0.15000  1.0 3.0
   51    53    58    61   0.15000  1.0 3.0
   52    51    53    54   0.15000  1.0 3.0
   52    51    53    55   0.15000  1.0 3.0
   52    51    53    58   0.15000  1.0 3.0
   53    55    62    63   0.15000  1.0 3.0
   53    55    62    64   0.15000  1.0 3.0
   53    55    62    65   0.56750  1.0 1.0
   53    55    62    65  -0.07550 -1.0 2.0
   53    55    62    65   0.20000  1.0 3.0
   54    53    55    56   0.15000  1.0 3.0
   54    53    55    57   0.15000  1.0 3.0
   54    53    55    62   0.15000  1.0 3.0
   54    53    58    59   0.15000  1.0 3.0
   54    53    58    60   0.15000  1.0 3.0
   54    53    58    61   0.15000  1.0 3.0
   55    53    58    59   0.15000  1.0 3.0
   55    53    58    60   0.15000  1.0 3.0
   55    53    58    61   0.15000  1.0 3.0
   55    62    65    66   0.15000  1.0 3.0
   55    62    65    38   0.56750  1.0 1.0
   55    62    65    38  -0.07550 -1.0 2.0
   55    62    65    38   0.20000  1.0 3.0
   55    62    65    67   0.34400  1.0 1.0
   55    62    65    67   0.09450 -1.0 2.0
   55    62    65    67   0.11100  1.0 3.0
   56    55    62    63   0.15000  1.0 3.0
   56    55    62    64   0.15000  1.0 3.0
   56    55    62    65   0.15000  1.0 3.0
   57    55    62    63   0.15000  1.0 3.0
   57    55    62    64   0.15000  1.0 3.0
   57    55    62    65   0.15000  1.0 3.0
   62    65    38    33   0.56750  1.0 1.0
   62    65    38    33  -0.07550 -1.0 2.0
   62    65    38    33   0.20000  1.0 3.0
   62    65    38    39   0.15000  1.0 3.0
   62    65    38    42   0.86500  1.0 1.0
   62    65    38    42  -0.17500 -1.0 2.0
   62    65    38    42   0.20800  1.0 3.0
   62    65    67    68   0.09850  1.0 1.0
   62    65    67    68   0.15250 -1.0 2.0
   62    65    67    68  -0.50650  1.0 3.0
   62    65    67    71   0.46850  1.0 1.0
   62    65    67    71   0.08550 -1.0 2.0
   62    65    67    71   0.09800  1.0 3.0
   63    62    65    66   0.15000  1.0 3.0
   63    62    65    38   0.15000  1.0 3.0
   63    62    65    67   0.15000  1.0 3.0
   64    62    65    66   0.15000  1.0 3.0
   64    62    65    38   0.15000  1.0 3.0
   64    62    65    67   0.15000  1.0 3.0
   65    38    42    43  -0.11600  1.0 1.0
   65    38    42    43  -0.09450 -1.0 2.0
   65    38    42    43   0.21250  1.0 3.0
   65    67    68    69   7.00000 -1.0 2.0
   65    67    68    70   7.00000 -1.0 2.0
   65    67    71    72   0.34800  1.0 3.0
   65    67    71    73   0.34800  1.0 3.0
   65    67    71    74   0.34800  1.0 3.0
   66    65    38    33   0.15000  1.0 3.0
   66    65    38    39   0.15000  1.0 3.0
   66    65    38    42   0.23400  1.0 3.0
   66    65    67    68   0.00000  1.0 1.0
   66    65    67    71   0.34800  1.0 3.0
   38    33    37    40   0.09850  1.0 1.0
   38    33    37    40   0.15250 -1.0 2.0
   38    33    37    40  -0.50650  1.0 3.0
   38    33    37    44   0.46850  1.0 1.0
   38    33    37    44   0.08550 -1.0 2.0
   38    33    37    44   0.09800  1.0 3.0
   38    33    51    48   0.56750  1.0 1.0
   38    33    51    48  -0.07550 -1.0 2.0
   38    33    51    48   0.20000  1.0 3.0
   38    33    51    52   0.15000  1.0 3.0
   38    33    51    53   0.56750  1.0 1.0
   38    33    51    53  -0.07550 -1.0 2.0
   38    33    51    53   0.20000  1.0 3.0
   38    65    67    68   0.09850  1.0 1.0
   38    65    67    68   0.15250 -1.0 2.0
   38    65    67    68  -0.50650  1.0 3.0
   38    65    67    71   0.46850  1.0 1.0
   38    65    67    71   0.08550 -1.0 2.0
   38    65    67    71   0.09800  1.0 3.0
   39    38    42    43   0.19450  1.0 3.0
   67    65    38    33   0.34400  1.0 1.0
   67    65    38    33   0.09450 -1.0 2.0
   67    65    38    33   0.11100  1.0 3.0
   67    65    38    39   0.15000  1.0 3.0
   67    65    38    42   1.05650  1.0 1.0
   67    65    38    42   0.15600 -1.0 2.0
   67    65    38    42   0.53150  1.0 3.0
   68    67    71    72   0.00000  1.0 1.0
   68    67    71    73   0.00000  1.0 1.0
   68    67    71    74   0.00000  1.0 1.0
   71    67    68    69   7.00000 -1.0 2.0
   71    67    68    70   7.00000 -1.0 2.0
   58    53    55    56   0.15000  1.0 3.0
   58    53    55    57   0.15000  1.0 3.0
   58    53    55    62   0.56750  1.0 1.0
   58    53    55    62  -0.07550 -1.0 2.0
   58    53    55    62   0.20000  1.0 3.0
   44    37    40    41   7.00000 -1.0 2.0
   44    37    40    48   7.00000 -1.0 2.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    34    35  10.50000 -1.0 2.0
   33    44    37    40   1.10000 -1.0 2.0
   48    41    40    37   1.10000 -1.0 2.0
   65    71    67    68  15.00000 -1.0 2.0
   69    70    68    67  15.00000 -1.0 2.0
END
