* LIGAND DATABASE FILE (OPLS2005)
*
001      68    70    119    193     350
    1     0 S   NP   _N1_     1    28.99707    96.71894   -23.27171
    2     1 S   H    _HN1     2     1.02829    40.82490   171.33571
    3     1 S   H    _H1_     3     1.02775   100.99440   -83.95181
    4     1 S   H    _H2_     4     1.02955    71.51550    21.92629
    5     1 S   CT   _CA1     5     1.50164   143.21653   121.47014
    6     5 S   HC   _HA1     6     1.09564   105.19418    91.59029
    7     5 S   CO3  _C1_     7     1.53874   112.19022   -28.64585
    8     7 S   O2Z  _O11     8     1.26387   114.93297   -43.94139
    9     7 S   O2Z  _O12     9     1.26204   115.06986   134.87392
   10     5 S   CT   _CB1    10     1.53144   107.37396  -150.31549
   11    10 S   HC   HB11    11     1.09823   109.63223   -47.40283
   12    10 S   HC   HB12    12     1.09801   110.46519    69.36788
   13    10 S   CT   _CG1    13     1.52884   112.36321  -168.23365
   14    13 S   HC   HG11    14     1.09575   110.56890   -61.98467
   15    13 S   HC   HG12    15     1.09538   109.61565    57.35781
   16    13 S   C    _CD1    16     1.51714   112.64622   177.29369
   17    16 S   O    _OE1    17     1.22708   123.29221     1.58140
   18    16 S   N    _N2_    18     1.38649   111.46443  -178.38396
   19    18 S   H    _HN2    19     1.01597   118.97730     1.84026
   20    18 S   CT1  _CA2    20     1.46267   123.51982  -178.78775
   21    20 S   HC   _HA2    21     1.09727   109.33548    -3.70021
   22    20 S   C    _C2_    22     1.53498   108.97898  -119.47826
   23    22 S   O    _O2_    23     1.23052   122.08027  -150.13304
   24    20 S   CT   _CB2    32     1.53392   111.13883   118.14024
   25    24 S   HC   HB21    33     1.09483   109.41085    57.32172
   26    24 S   HC   HB22    34     1.09505   110.77553   175.95281
   27    22 S   N    _N3_    24     1.38468   113.67252    37.44061
   28    27 S   H    _HN3    25     1.01499   118.89089    -1.11347
   29    24 S   S    _SG2    35     1.82820   111.26055   -64.41491
   30    27 S   CT   _CA3    26     1.45443   123.55494   175.11084
   31    30 S   HC   HA31    27     1.09516   109.35548    22.51608
   32    30 S   HC   HA32    28     1.09500   107.10316   139.51781
   33    29 S   CT   _C16    36     1.82893    99.66221   161.58172
   34    33 S   HC   _H3_    37     1.09516   108.53483    52.72834
   35    30 S   CO3  _C3_    29     1.52908   112.98163  -101.04647
   36    35 S   O2Z  _O31    30     1.26413   115.34154   -46.55010
   37    35 S   O2Z  _O32    31     1.26350   115.03345   134.35612
   38    33 S   CM   _C15    38     1.50444   110.77776   -71.52119
   39    38 S   HC   _H11    39     1.08915   115.68797   -47.08798
   40    33 S   CO3  _C17    66     1.53575   103.06661   169.04521
   41    40 S   O2Z  _O34    67     1.26539   117.22801    80.60833
   42    40 S   O2Z  _O33    68     1.26828   114.42190   -99.55601
   43    38 S   CMA  _C14    40     1.35435   125.61807   133.84972
   44    43 S   OM   _O35    41     1.26048   129.74317     4.06370
   45    43 S   NE   _N4_    42     1.38511   122.33471  -179.87180
   46    45 S   H    _H10    43     1.01426   112.84762  -155.73453
   47    45 S   CA   _C13    44     1.40679   131.11259    34.51100
   48    47 S   CA   _C12    45     1.39948   118.81443  -157.30263
   49    48 S   HA   _H9_    46     1.08821   119.99698    -0.66529
   50    48 S   CA   _C11    47     1.40308   121.31171   178.90140
   51    50 S   HA   _H8_    48     1.08687   116.86788  -179.89532
   52    50 S   CA   _C10    49     1.41427   121.95141     0.40494
   53    52 S   CA   _C8_    50     1.42011   125.51163   179.50782
   54    52 S   CA   _C19    63     1.39291   115.32753    -0.42428
   55    53 S   CA   _C9_    51     1.41672   123.79387     1.46460
   56    55 S   HA   _H7_    52     1.08718   121.07914     0.09279
   57    47 S   CA   _C18    64     1.39610   123.67230    20.95596
   58    57 S   HA   _H12    65     1.08635   120.61160     2.74823
   59    55 S   CA   _C4_    53     1.39890   122.19916   179.81762
   60    59 S   HA   _H4_    54     1.08638   119.89660  -179.84051
   61    59 S   CA   _C5_    55     1.38696   120.02203     0.03956
   62    61 S   HA   _H5_    56     1.08582   120.28826  -179.89347
   63    61 S   CA   _C6_    57     1.39017   119.47070     0.09279
   64    63 S   HA   _H6_    58     1.08734   118.58445  -179.97202
   65    53 S   CA   _C7_    59     1.40468   119.98313  -178.52594
   66    65 S   CO4  _C20    60     1.48129   121.01562     0.61960
   67    66 S   O    _O37    61     1.22447   122.25158   177.09189
   68    66 S   OS   _O36    62     1.38579   116.07738    -2.72993
  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   8   5   4   3
   9   6   2   1   1   9   4   3   1   1   6   3   8   3   9   8
   4   8   3  11  13   7   8   4   3   1   6   3   5   3   5   2
   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    43    40    41    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    43    44    45    40    41    42  
   38    39    43    40    41    42  
   36    37  
   37  
    0  
   39    43    44    45    46    47    40    41    42  
   43    44    45    40  
   41    42    43  
   42  
    0  
   44    45    46    47    48    57  
   45    46    47  
   46    47    48    49    50    54    57    58  
   47    48    57  
   48    49    50    51    52    68    54    57    58  
   49    50    51    52    53    54    57    58  
   50    51    52    57  
   51    52    53    55    65    68    54    57  
   52    53    54  
   53    55    56    59    63    65    66    68    54    57    58  
   55    56    59    60    61    63    64    65    66    67    68    54    57  
   57    58    55    65    66    67    68  
   56    59    60    61    62    63    65    66  
   59    60    61    65  
   58    66    68  
   68  
   60    61    62    63    64    65  
   61    62    63  
   62    63    64    65    66  
   63    64    65  
   64    65    66    67    68  
   65    66  
   66    67    68  
   67    68  
   68  
    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   0.007500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   43   3.5500   0.0760   0.497600   2.0020   1.7750   0.023028004  -0.852763146
   44   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   45   3.2500   0.1700  -1.076200   1.8650   1.6500   0.051222218  -2.220205820
   46   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   47   3.5500   0.0700   0.200000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   50   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   51   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   52   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   53   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   54   3.5500   0.0700   0.135000   2.5000   1.7750   0.001000000  -0.843144165
   55   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   56   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   60   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   61   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   63   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   65   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   66   3.7500   0.1050   0.625000   2.1120   1.8750   0.001000000  -0.126889456
   67   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   68   3.0000   0.1700  -0.215000   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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   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    38   317.000  1.510
   33    40   317.000  1.522
   38    39   340.000  1.080
   38    43   465.000  1.376
   43    44   745.000  1.250
   43    45   415.000  1.382
   45    46   434.000  1.010
   45    47   481.000  1.340
   47    48   469.000  1.400
   47    57   469.000  1.400
   48    49   367.000  1.080
   48    50   469.000  1.400
   50    51   367.000  1.080
   50    52   469.000  1.400
   52    53   375.000  1.464
   52    54   469.000  1.400
   53    55   469.000  1.400
   53    65   469.000  1.400
   55    56   367.000  1.080
   55    59   469.000  1.400
   59    60   367.000  1.080
   59    61   469.000  1.400
   61    62   367.000  1.080
   61    63   469.000  1.400
   63    64   367.000  1.080
   63    65   469.000  1.400
   65    66   310.000  1.470
   66    67   570.000  1.229
   66    68   214.000  1.327
   68    54   450.000  1.364
   54    57   469.000  1.400
   57    58   367.000  1.080
   40    41   656.000  1.250
   40    42   656.000  1.250
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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    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    38    75.00000  112.20000
   29    33    40    70.00000  116.78000
   33    38    39    35.00000  117.00000
   33    38    43    70.00000  124.00000
   33    40    41    70.00000  117.00000
   33    40    42    70.00000  117.00000
   38    33    34    35.00000  109.50000
   38    43    44    65.00000  137.10300
   38    43    45    75.00000  114.40000
   43    38    39    40.00000  120.50800
   43    45    46    50.00000  121.48000
   43    45    47    75.00000  121.78000
   45    43    44   105.00000  113.92000
   45    47    48    70.00000  120.10000
   45    47    57    70.00000  120.10000
   47    45    46    35.00000  113.50000
   47    48    49    35.00000  120.00000
   47    48    50    63.00000  120.00000
   47    57    54    63.00000  120.00000
   47    57    58    35.00000  120.00000
   48    50    51    35.00000  120.00000
   48    50    52    63.00000  120.00000
   50    48    49    35.00000  120.00000
   50    52    53    60.00000  122.76000
   50    52    54    63.00000  120.00000
   52    50    51    35.00000  120.00000
   52    53    55    60.00000  122.76000
   52    53    65    60.00000  122.76000
   52    54    68    70.00000  120.00000
   52    54    57    63.00000  120.00000
   53    55    56    35.00000  120.00000
   53    55    59    63.00000  120.00000
   53    65    63    63.00000  120.00000
   53    65    66    60.00000  119.52600
   55    59    60    35.00000  120.00000
   55    59    61    63.00000  120.00000
   59    55    56    35.00000  120.00000
   59    61    62    35.00000  120.00000
   59    61    63    63.00000  120.00000
   61    59    60    35.00000  120.00000
   61    63    64    35.00000  120.00000
   61    63    65    63.00000  120.00000
   63    61    62    35.00000  120.00000
   63    65    66    60.00000  119.52600
   65    53    55    63.00000  120.00000
   65    63    64    35.00000  120.00000
   65    66    67    75.00000  123.78400
   65    66    68    81.00000  111.40000
   66    68    54    85.00000  115.98000
   68    66    67    83.00000  123.40000
   68    54    57    70.00000  120.00000
   54    52    53    60.00000  122.76000
   54    57    58    35.00000  120.00000
   57    47    48    63.00000  120.00000
   40    33    34    35.00000  109.50000
   40    33    38    65.00000  111.94000
   42    40    41    80.00000  126.00000
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    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -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    35    36   0.00000  1.0 1.0
   27    30    35    37   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    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   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    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   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    38    39   0.00000  1.0 1.0
   29    33    38    43   0.42700  1.0 1.0
   29    33    38    43  -0.70350 -1.0 2.0
   29    33    38    43  -0.43150  1.0 3.0
   29    33    40    41   0.30150 -1.0 2.0
   29    33    40    42   0.30150 -1.0 2.0
   33    38    43    44   7.00000 -1.0 2.0
   33    38    43    45   7.00000 -1.0 2.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    43   0.00000  1.0 1.0
   34    33    40    41   0.00000  1.0 1.0
   34    33    40    42   0.00000  1.0 1.0
   38    33    40    41   0.30150 -1.0 2.0
   38    33    40    42   0.30150 -1.0 2.0
   38    43    45    46   1.00000 -1.0 2.0
   38    43    45    47  -0.54500  1.0 1.0
   38    43    45    47   1.14150 -1.0 2.0
   39    38    43    44   7.00000 -1.0 2.0
   39    38    43    45   7.00000 -1.0 2.0
   43    45    47    48   0.70250  1.0 1.0
   43    45    47    48   1.56150 -1.0 2.0
   43    45    47    57   0.70250  1.0 1.0
   43    45    47    57   1.56150 -1.0 2.0
   44    43    45    46   1.00000 -1.0 2.0
   44    43    45    47   1.00000 -1.0 2.0
   45    47    48    49   3.62500 -1.0 2.0
   45    47    48    50   3.62500 -1.0 2.0
   45    47    57    54   3.62500 -1.0 2.0
   45    47    57    58   3.62500 -1.0 2.0
   46    45    47    48   1.00000 -1.0 2.0
   46    45    47    57   1.00000 -1.0 2.0
   47    48    50    51   3.62500 -1.0 2.0
   47    48    50    52   3.62500 -1.0 2.0
   48    47    57    54   3.62500 -1.0 2.0
   48    47    57    58   3.62500 -1.0 2.0
   48    50    52    53   3.62500 -1.0 2.0
   48    50   -52    54   3.62500 -1.0 2.0
   49    48    50    51   3.62500 -1.0 2.0
   49    48    50    52   3.62500 -1.0 2.0
   50    52    53    55  -0.19450  1.0 1.0
   50    52    53    55   0.63300 -1.0 2.0
   50    52    53    55   0.07450  1.0 3.0
   50    52    53    65  -0.19450  1.0 1.0
   50    52    53    65   0.63300 -1.0 2.0
   50    52    53    65   0.07450  1.0 3.0
   50    52    54    68   3.62500 -1.0 2.0
   50    52    54    57   3.62500 -1.0 2.0
   51    50    52    53   3.62500 -1.0 2.0
   51    50    52    54   3.62500 -1.0 2.0
   52    53    55    56   3.62500 -1.0 2.0
   52    53    55    59   3.62500 -1.0 2.0
   52    53    65    63   3.62500 -1.0 2.0
   52    53    65    66   3.62500 -1.0 2.0
   52    54   -57    47   3.62500 -1.0 2.0
   52    54    57    58   3.62500 -1.0 2.0
   53    52    54    68   3.62500 -1.0 2.0
   53    52    54    57   3.62500 -1.0 2.0
   53    55    59    60   3.62500 -1.0 2.0
   53    55    59    61   3.62500 -1.0 2.0
   53    65    66    67   1.05000 -1.0 2.0
   53    65   -66    68   0.98750 -1.0 2.0
   55    53    65    63   3.62500 -1.0 2.0
   55    53    65    66   3.62500 -1.0 2.0
   55    59    61    62   3.62500 -1.0 2.0
   55    59   -61    63   3.62500 -1.0 2.0
   56    55    59    60   3.62500 -1.0 2.0
   56    55    59    61   3.62500 -1.0 2.0
   59    61    63    64   3.62500 -1.0 2.0
   59    61    63    65   3.62500 -1.0 2.0
   60    59    61    62   3.62500 -1.0 2.0
   60    59    61    63   3.62500 -1.0 2.0
   61    63   -65    53   3.62500 -1.0 2.0
   61    63    65    66   3.62500 -1.0 2.0
   62    61    63    64   3.62500 -1.0 2.0
   62    61    63    65   3.62500 -1.0 2.0
   63    65    66    67   1.05000 -1.0 2.0
   63    65    66    68   0.98750 -1.0 2.0
   64    63    65    53   3.62500 -1.0 2.0
   64    63    65    66   3.62500 -1.0 2.0
   65    53    55    56   3.62500 -1.0 2.0
   65    53   -55    59   3.62500 -1.0 2.0
   65    66    68    54   2.00000 -1.0 2.0
   66    68   -54    52   0.01300  1.0 1.0
   66    68   -54    52   0.97950 -1.0 2.0
   66    68   -54    52  -0.55700  1.0 3.0
   66    68    54    57   0.01300  1.0 1.0
   66    68    54    57   0.97950 -1.0 2.0
   66    68    54    57  -0.55700  1.0 3.0
   67    66    68    54   3.00000 -1.0 2.0
   68    54    57    47   3.62500 -1.0 2.0
   68    54    57    58   3.62500 -1.0 2.0
   54    52    53    55  -0.19450  1.0 1.0
   54    52    53    55   0.63300 -1.0 2.0
   54    52    53    55   0.07450  1.0 3.0
   54    52   -53    65  -0.19450  1.0 1.0
   54    52   -53    65   0.63300 -1.0 2.0
   54    52   -53    65   0.07450  1.0 3.0
   57    47    48    49   3.62500 -1.0 2.0
   57    47   -48    50   3.62500 -1.0 2.0
   40    33    38    39   0.00000  1.0 1.0
   40    33    38    43  -0.51250  1.0 1.0
   40    33    38    43  -0.88800 -1.0 2.0
   40    33    38    43   0.08850  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   33    39    38    43  15.00000 -1.0 2.0
   45    44    43    38  15.00000 -1.0 2.0
   46    43    45    47   1.00000 -1.0 2.0
   48    57    47    45   4.00000 -1.0 2.0
   50    49    48    47   1.10000 -1.0 2.0
   52    51    50    48   1.10000 -1.0 2.0
   53    54    52    50   4.00000 -1.0 2.0
   55    65    53    52   4.00000 -1.0 2.0
   59    56    55    53   1.10000 -1.0 2.0
   61    60    59    55   1.10000 -1.0 2.0
   63    62    61    59   1.10000 -1.0 2.0
   65    64    63    61   1.10000 -1.0 2.0
   63    66    65    53   4.00000 -1.0 2.0
   65    68    66    67  10.50000 -1.0 2.0
   68    57    54    52   4.00000 -1.0 2.0
   54    58    57    47   1.10000 -1.0 2.0
   41    33    40    42  10.50000 -1.0 2.0
END
