* LIGAND DATABASE FILE (OPLS2005)
*
001      71    73    137    219     408
    1     0 S   NP   _N1_     1    28.68466    94.92040   -23.90161
    2     1 S   H    _HN1     2     1.02829    30.47316  -178.01920
    3     1 S   H    _H1_     3     1.02785   108.15644   -83.43086
    4     1 S   H    _H2_     4     1.02950    78.47942    22.32023
    5     1 S   CT   _CA1     5     1.50107   132.48022   129.53364
    6     5 S   HC   _HA1     6     1.09573   105.20547    84.71322
    7     5 S   CO3  _C1_     7     1.53795   112.44034   -35.53582
    8     7 S   O2Z  _O11     8     1.26372   115.01122   -43.19724
    9     7 S   O2Z  _O12     9     1.26240   114.94483   135.95342
   10     5 S   CT   _CB1    10     1.53082   107.42247  -157.30854
   11    10 S   HC   HB11    11     1.09831   109.39086   -49.81319
   12    10 S   HC   HB12    12     1.09813   110.44587    66.80150
   13    10 S   CT   _CG1    13     1.52981   112.58540  -170.79421
   14    13 S   HC   HG11    14     1.09586   110.60803   -65.10001
   15    13 S   HC   HG12    15     1.09670   109.80864    54.12240
   16    13 S   C    _CD1    16     1.51797   112.26104   174.58109
   17    16 S   O    _OE1    17     1.22730   123.29749     5.72872
   18    16 S   N    _N2_    18     1.38627   111.61864  -174.35409
   19    18 S   H    _HN2    19     1.01585   119.00852     1.69950
   20    18 S   CT1  _CA2    20     1.46238   123.46883   178.04175
   21    20 S   HC   _HA2    21     1.09750   109.31521     2.90003
   22    20 S   C    _C2_    22     1.53609   109.01147  -112.52725
   23    22 S   O    _O2_    23     1.23064   122.24466  -151.55768
   24    20 S   CT   _CB2    32     1.53561   111.37411   124.82123
   25    24 S   HC   HB21    33     1.09436   109.10993    55.18792
   26    24 S   HC   HB22    34     1.09015   109.49566   174.02073
   27    22 S   N    _N3_    24     1.38320   113.82842    36.08580
   28    27 S   H    _HN3    25     1.01571   119.55328    -3.60207
   29    24 S   S    _SG2    35     1.83038   110.61420   -65.83989
   30    27 S   CT   _CA3    26     1.45271   123.20737   177.03766
   31    30 S   HC   HA31    27     1.09549   107.54030   -64.03638
   32    30 S   HC   HA32    28     1.09557   107.95666    52.40040
   33    29 S   CT   _C16    36     1.86440   104.06872  -178.69434
   34    30 S   CO3  _C3_    29     1.52949   114.07961   174.39486
   35    34 S   O2Z  _O31    30     1.26375   116.07792     0.05234
   36    34 S   O2Z  _O32    31     1.26428   114.41223  -179.90309
   37    33 S   CM   _C4_    37     1.52853   109.00575   -43.69908
   38    33 S   CT   _C10    61     1.55583   106.16680  -163.20278
   39    38 S   HC   _H24    62     1.10093   108.72213   148.15400
   40    38 S   HC   _H25    63     1.09947   109.86231    35.25563
   41    37 S   CMA  _C5_    38     1.35011   112.68856   109.11763
   42    41 S   OM   _O16    39     1.25707   135.34102  -179.29196
   43    37 S   CT   _C17    68     1.50000   121.86831   -70.00130
   44    43 S   HC   _H32    69     1.09389   110.83920   -65.20416
   45    43 S   HC   _H33    70     1.09484   112.05944   175.01850
   46    43 S   HC   _H34    71     1.09402   110.97443    55.30812
   47    41 S   CT   _C9_    40     1.51310   110.17410    -0.33920
   48    47 S   HC   _H22    41     1.09830   112.60856   135.37400
   49    47 S   HC   _H23    42     1.09394   110.86518  -103.67302
   50    33 S   CT   _C13    43     1.55654   118.96605    70.82522
   51    50 S   HC   _H29    44     1.10506   105.76973   158.66881
   52    50 S   CT   _C14    45     1.54822   122.60164    40.26636
   53    52 S   HC   _H30    46     1.10118   105.02020   179.96574
   54    52 S   CT   _C11    47     1.53996   113.68810    65.78346
   55    54 S   HC   _H26    48     1.09942   108.48565    75.39064
   56    54 S   HC   _H27    49     1.09871   109.59371  -171.85023
   57    52 S   CT   _C18    64     1.53065   117.60010   -64.99359
   58    57 S   HC   _H35    65     1.09128   112.84832    77.93192
   59    57 S   HC   _H36    66     1.09184   112.25313   -46.08788
   60    57 S   HC   _H37    67     1.09703   109.63089  -164.07498
   61    54 S   CT   _C15    50     1.52883   116.64454   -47.45650
   62    61 S   HC   _H31    51     1.09339   111.06244   -56.39428
   63    61 S   CT   _C12    52     1.52207   113.01699    72.81665
   64    63 S   HC   _H28    53     1.10014   108.78139    34.67989
   65    63 S   CM   _C6_    54     1.49434   100.38890   145.48931
   66    65 S   CO4  _C7_    55     1.47695   108.36032   -23.12697
   67    66 S   O    _O17    56     1.21738   127.15467  -169.65174
   68    65 S   CM   _C8_    58     1.33612   130.23669   156.34904
   69    68 S   HC   _H20    59     1.08467   121.20764     0.76208
   70    68 S   HC   _H21    60     1.08532   121.65942  -179.60534
   71    61 S   OS   _O18    57     1.44683   107.33830  -171.84365
  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
  23   2   1   1  16  17   6   5  11   5   5   2   1   1   8   4
   3  12   4  12   8  13   6   5   4   2   1   1   8   5   8   4
   6   5   2   3   1   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    50    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    41    47    50    51    52    63    38    39    40    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    41    42    47    48    49    50    51    52    53    54    61    63    64    65    38    39    40    57    43    44    45    46  
   35    36  
   36  
    0  
   41    42    47    48    49    50    51    52    63    38    39    40    43    44    45    46  
   39    40    43    41    47    50    51    52    54    61    62    63    64    65    66    68    71  
   40    50    61    63    64    65  
   50    61    63    64    65  
   42    47    48    49    50    51    52    43    44    45    46  
   47    48    49    50    43  
   44    45    46    47    50  
   45    46  
   46  
    0  
   48    49    50    51    52    53    54    57  
   49    50    51    52  
   50    51    52  
   51    52    53    54    55    56    61    63    57    58    59    60  
   52    53    54    57  
   53    54    55    56    61    62    63    71    57    58    59    60  
   54    55    56    61    57    58    59    60  
   55    56    61    62    63    64    65    66    71    57    58    59    60  
   56    61    62    63    71    57  
   61    62    63    71    57  
   58    59    60    61  
   59    60  
   60  
    0  
   62    63    64    65    66    67    71    68  
   63    64    65    66    71  
   64    65    66    67    71    68    69    70  
   65    66    71    68  
   66    67    71    68    69    70  
   67    71    68    69    70  
   71    68  
   69    70    71  
   70  
    0  
    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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   63   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   66   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   67   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   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   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
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    50   268.000  1.529
   33    38   268.000  1.529
   37    41   465.000  1.376
   37    43   317.000  1.510
   41    42   745.000  1.250
   41    47   270.000  1.512
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    50   268.000  1.529
   50    51   340.000  1.090
   50    52   268.000  1.529
   52    53   340.000  1.090
   52    54   268.000  1.529
   52    57   268.000  1.529
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    61   268.000  1.529
   61    62   340.000  1.090
   61    63   268.000  1.529
   61    71   320.000  1.410
   63    64   340.000  1.090
   63    65   317.000  1.510
   63    38   268.000  1.529
   65    66   320.000  1.462
   65    68   549.000  1.340
   66    67   570.000  1.229
   66    71   214.000  1.327
   68    69   340.000  1.080
   68    70   340.000  1.080
   38    39   340.000  1.090
   38    40   340.000  1.090
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    46   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    50    75.00000  111.63000
   29    33    38    75.00000  111.63000
   33    37    41    70.00000  124.00000
   33    37    43    65.00000  117.92700
   33    50    47    58.35000  112.70000
   33    50    51    37.50000  110.70000
   33    50    52    58.35000  112.70000
   33    38    63    58.35000  112.70000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   37    41    42    65.00000  137.10300
   37    41    47    65.00000  122.18000
   37    43    44    35.00000  109.50000
   37    43    45    35.00000  109.50000
   37    43    46    35.00000  109.50000
   41    47    48    45.00000  110.52000
   41    47    49    45.00000  110.52000
   41    47    50    70.00000  112.02700
   47    41    42    85.00000  112.85300
   47    50    51    37.50000  110.70000
   47    50    52    58.35000  112.70000
   49    47    48    33.00000  107.80000
   50    33    37    70.00000  112.02700
   50    47    48    37.50000  110.70000
   50    47    49    37.50000  110.70000
   50    52    53    37.50000  110.70000
   50    52    54    58.35000  112.70000
   50    52    57    58.35000  112.70000
   52    50    51    37.50000  110.70000
   52    54    55    37.50000  110.70000
   52    54    56    37.50000  110.70000
   52    54    61    58.35000  112.70000
   52    57    58    37.50000  110.70000
   52    57    59    37.50000  110.70000
   52    57    60    37.50000  110.70000
   54    52    53    37.50000  110.70000
   54    61    62    37.50000  110.70000
   54    61    63    58.35000  112.70000
   54    61    71    50.00000  109.50000
   56    54    55    33.00000  107.80000
   61    54    55    37.50000  110.70000
   61    54    56    37.50000  110.70000
   61    63    64    37.50000  110.70000
   61    63    65    70.00000  112.02700
   61    63    38    58.35000  112.70000
   61    71    66    83.00000  116.90000
   63    61    62    37.50000  110.70000
   63    65    66    65.00000  116.34900
   63    65    68    70.00000  124.00000
   63    38    39    37.50000  110.70000
   63    38    40    37.50000  110.70000
   65    63    64    35.00000  109.50000
   65    66    67    80.00000  123.72100
   65    66    71    90.00000  111.29400
   65    68    69    35.00000  120.00000
   65    68    70    35.00000  120.00000
   71    61    62    35.00000  109.50000
   71    61    63    50.00000  109.50000
   71    66    67    83.00000  123.40000
   68    65    66    65.00000  118.96000
   70    68    69    35.00000  117.00000
   38    33    37    70.00000  112.02700
   38    33    50    58.35000  112.70000
   38    63    64    37.50000  110.70000
   38    63    65    70.00000  112.02700
   40    38    39    33.00000  107.80000
   57    52    53    37.50000  110.70000
   57    52    54    58.35000  112.70000
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
   43    37    41    70.00000  124.00000
   45    43    44    33.00000  107.80000
   46    43    44    33.00000  107.80000
   46    43    45    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    50   0.01700  1.0 1.0
   24    29    33    50  -0.23550 -1.0 2.0
   24    29    33    50   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    41   0.42700  1.0 1.0
   29    33    37    41  -0.70350 -1.0 2.0
   29    33    37    41  -0.43150  1.0 3.0
   29    33    37    43   0.30250  1.0 1.0
   29    33    37    43  -0.14950 -1.0 2.0
   29    33    37    43   0.36900  1.0 3.0
   29    33    50    47   0.44750  1.0 1.0
   29    33    50    47  -0.17800 -1.0 2.0
   29    33    50    47   0.20200  1.0 3.0
   29    33    50    51   0.15000  1.0 3.0
   29    33    50    52   0.44750  1.0 1.0
   29    33    50    52  -0.17800 -1.0 2.0
   29    33    50    52   0.20200  1.0 3.0
   29    33    38    63   0.44750  1.0 1.0
   29    33    38    63  -0.17800 -1.0 2.0
   29    33    38    63   0.20200  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   33    37    41    42   7.00000 -1.0 2.0
   33    37   -41    47   7.00000 -1.0 2.0
   33    37    43    44   0.34800  1.0 3.0
   33    37    43    45   0.34800  1.0 3.0
   33    37    43    46   0.34800  1.0 3.0
   33    50    52    53   0.15000  1.0 3.0
   33    50    52    54   0.56750  1.0 1.0
   33    50    52    54  -0.07550 -1.0 2.0
   33    50    52    54   0.20000  1.0 3.0
   33    50    52    57   0.56750  1.0 1.0
   33    50    52    57  -0.07550 -1.0 2.0
   33    50    52    57   0.20000  1.0 3.0
   37    33   -50    47   0.34400  1.0 1.0
   37    33   -50    47   0.09450 -1.0 2.0
   37    33   -50    47   0.11100  1.0 3.0
   37    33    50    51   0.15000  1.0 3.0
   37    33    50    52   0.34400  1.0 1.0
   37    33    50    52   0.09450 -1.0 2.0
   37    33    50    52   0.11100  1.0 3.0
   37    33    38    63   0.34400  1.0 1.0
   37    33    38    63   0.09450 -1.0 2.0
   37    33    38    63   0.11100  1.0 3.0
   37    33    38    39   0.15000  1.0 3.0
   37    33    38    40   0.15000  1.0 3.0
   37    41    47    48   0.00000  1.0 1.0
   37    41    47    49   0.00000  1.0 1.0
   37    41   -47    50   0.09850  1.0 1.0
   37    41   -47    50   0.15250 -1.0 2.0
   37    41   -47    50  -0.50650  1.0 3.0
   41    37    43    44   0.00000  1.0 1.0
   41    37    43    45   0.00000  1.0 1.0
   41    37    43    46   0.00000  1.0 1.0
   41    47   -50    33   0.34400  1.0 1.0
   41    47   -50    33   0.09450 -1.0 2.0
   41    47   -50    33   0.11100  1.0 3.0
   41    47    50    51   0.15000  1.0 3.0
   41    47    50    52   0.34400  1.0 1.0
   41    47    50    52   0.09450 -1.0 2.0
   41    47    50    52   0.11100  1.0 3.0
   42    41    47    48   0.00000  1.0 1.0
   42    41    47    49   0.00000  1.0 1.0
   42    41    47    50   0.09700  1.0 1.0
   42    41    47    50   0.15600 -1.0 2.0
   42    41    47    50  -0.50800  1.0 3.0
   47    50    52    53   0.15000  1.0 3.0
   47    50    52    54   0.56750  1.0 1.0
   47    50    52    54  -0.07550 -1.0 2.0
   47    50    52    54   0.20000  1.0 3.0
   47    50    52    57   0.56750  1.0 1.0
   47    50    52    57  -0.07550 -1.0 2.0
   47    50    52    57   0.20000  1.0 3.0
   48    47    50    33   0.15000  1.0 3.0
   48    47    50    51   0.15000  1.0 3.0
   48    47    50    52   0.15000  1.0 3.0
   49    47    50    33   0.15000  1.0 3.0
   49    47    50    51   0.15000  1.0 3.0
   49    47    50    52   0.15000  1.0 3.0
   50    33   -37    41   0.09850  1.0 1.0
   50    33   -37    41   0.15250 -1.0 2.0
   50    33   -37    41  -0.50650  1.0 3.0
   50    33    37    43   0.46850  1.0 1.0
   50    33    37    43   0.08550 -1.0 2.0
   50    33    37    43   0.09800  1.0 3.0
   50    33    38    63   0.56750  1.0 1.0
   50    33    38    63  -0.07550 -1.0 2.0
   50    33    38    63   0.20000  1.0 3.0
   50    33    38    39   0.15000  1.0 3.0
   50    33    38    40   0.15000  1.0 3.0
   50    52    54    55   0.15000  1.0 3.0
   50    52    54    56   0.15000  1.0 3.0
   50    52    54    61   0.56750  1.0 1.0
   50    52    54    61  -0.07550 -1.0 2.0
   50    52    54    61   0.20000  1.0 3.0
   50    52    57    58   0.15000  1.0 3.0
   50    52    57    59   0.15000  1.0 3.0
   50    52    57    60   0.15000  1.0 3.0
   51    50    52    53   0.15000  1.0 3.0
   51    50    52    54   0.15000  1.0 3.0
   51    50    52    57   0.15000  1.0 3.0
   52    54    61    62   0.15000  1.0 3.0
   52    54    61    63   0.56750  1.0 1.0
   52    54    61    63  -0.07550 -1.0 2.0
   52    54    61    63   0.20000  1.0 3.0
   52    54    61    71   0.62750  1.0 1.0
   52    54    61    71  -0.30950 -1.0 2.0
   52    54    61    71   0.27300  1.0 3.0
   53    52    54    55   0.15000  1.0 3.0
   53    52    54    56   0.15000  1.0 3.0
   53    52    54    61   0.15000  1.0 3.0
   53    52    57    58   0.15000  1.0 3.0
   53    52    57    59   0.15000  1.0 3.0
   53    52    57    60   0.15000  1.0 3.0
   54    52    57    58   0.15000  1.0 3.0
   54    52    57    59   0.15000  1.0 3.0
   54    52    57    60   0.15000  1.0 3.0
   54    61    63    64   0.15000  1.0 3.0
   54    61    63    65   0.34400  1.0 1.0
   54    61    63    65   0.09450 -1.0 2.0
   54    61    63    65   0.11100  1.0 3.0
   54    61    63    38   0.56750  1.0 1.0
   54    61    63    38  -0.07550 -1.0 2.0
   54    61    63    38   0.20000  1.0 3.0
   54    61    71    66  -0.25900  1.0 1.0
   54    61    71    66  -0.47000 -1.0 2.0
   54    61    71    66   0.11750  1.0 3.0
   55    54    61    62   0.15000  1.0 3.0
   55    54    61    63   0.15000  1.0 3.0
   55    54    61    71   0.23400  1.0 3.0
   56    54    61    62   0.15000  1.0 3.0
   56    54    61    63   0.15000  1.0 3.0
   56    54    61    71   0.23400  1.0 3.0
   61    63   -65    66   0.09700  1.0 1.0
   61    63   -65    66   0.15600 -1.0 2.0
   61    63   -65    66  -0.50800  1.0 3.0
   61    63    65    68   0.09850  1.0 1.0
   61    63    65    68   0.15250 -1.0 2.0
   61    63    65    68  -0.50650  1.0 3.0
   61    63    38    33   0.56750  1.0 1.0
   61    63    38    33  -0.07550 -1.0 2.0
   61    63    38    33   0.20000  1.0 3.0
   61    63    38    39   0.15000  1.0 3.0
   61    63    38    40   0.15000  1.0 3.0
   62    61    63    64   0.15000  1.0 3.0
   62    61    63    65   0.15000  1.0 3.0
   62    61    63    38   0.15000  1.0 3.0
   62    61    71    66   0.08050  1.0 3.0
   63    61   -71    66  -0.25900  1.0 1.0
   63    61   -71    66  -0.47000 -1.0 2.0
   63    61   -71    66   0.11750  1.0 3.0
   63    65    66    67  -0.64400  1.0 1.0
   63    65    66    67   0.26850 -1.0 2.0
   63    65   -66    71  -0.15000  1.0 1.0
   63    65   -66    71   0.89550 -1.0 2.0
   63    65   -66    71  -0.06900  1.0 3.0
   63    65    68    69   7.00000 -1.0 2.0
   63    65    68    70   7.00000 -1.0 2.0
   64    63    65    66   0.15000  1.0 3.0
   64    63    65    68   0.00000  1.0 1.0
   64    63    38    33   0.15000  1.0 3.0
   64    63    38    39   0.15000  1.0 3.0
   64    63    38    40   0.15000  1.0 3.0
   65    63    38    33   0.34400  1.0 1.0
   65    63    38    33   0.09450 -1.0 2.0
   65    63    38    33   0.11100  1.0 3.0
   65    63    38    39   0.15000  1.0 3.0
   65    63    38    40   0.15000  1.0 3.0
   65    66   -71    61   2.00000 -1.0 2.0
   66    65    68    69   7.00000 -1.0 2.0
   66    65    68    70   7.00000 -1.0 2.0
   67    66    71    61   3.00000 -1.0 2.0
   71    61    63    64   0.23400  1.0 3.0
   71    61   -63    65   0.61850  1.0 1.0
   71    61   -63    65  -0.22750 -1.0 2.0
   71    61   -63    65   0.15300  1.0 3.0
   71    61    63    38   0.62750  1.0 1.0
   71    61    63    38  -0.30950 -1.0 2.0
   71    61    63    38   0.27300  1.0 3.0
   68    65    66    67   1.00000 -1.0 2.0
   68    65    66    71  -0.56150  1.0 1.0
   68    65    66    71   2.19150 -1.0 2.0
   38    33    37    41   0.09850  1.0 1.0
   38    33    37    41   0.15250 -1.0 2.0
   38    33    37    41  -0.50650  1.0 3.0
   38    33    37    43   0.46850  1.0 1.0
   38    33    37    43   0.08550 -1.0 2.0
   38    33    37    43   0.09800  1.0 3.0
   38    33    50    47   0.56750  1.0 1.0
   38    33    50    47  -0.07550 -1.0 2.0
   38    33    50    47   0.20000  1.0 3.0
   38    33    50    51   0.15000  1.0 3.0
   38    33    50    52   0.56750  1.0 1.0
   38    33    50    52  -0.07550 -1.0 2.0
   38    33    50    52   0.20000  1.0 3.0
   38    63    65    66   0.09700  1.0 1.0
   38    63    65    66   0.15600 -1.0 2.0
   38    63    65    66  -0.50800  1.0 3.0
   38    63    65    68   0.09850  1.0 1.0
   38    63    65    68   0.15250 -1.0 2.0
   38    63    65    68  -0.50650  1.0 3.0
   57    52    54    55   0.15000  1.0 3.0
   57    52    54    56   0.15000  1.0 3.0
   57    52    54    61   0.56750  1.0 1.0
   57    52    54    61  -0.07550 -1.0 2.0
   57    52    54    61   0.20000  1.0 3.0
   43    37    41    42   7.00000 -1.0 2.0
   43    37    41    47   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    43    37    41   1.10000 -1.0 2.0
   47    42    41    37   1.10000 -1.0 2.0
   63    66    65    68   1.10000 -1.0 2.0
   65    71    66    67  10.50000 -1.0 2.0
   69    70    68    65   1.10000 -1.0 2.0
END
