* LIGAND DATABASE FILE (OPLS2005)
*
001      82    85    153    253     459
    1     0 S   NP   _N1_     1    28.92371    97.11072   -21.08866
    2     1 S   H    _HN1     2     1.02836    46.54265   160.21470
    3     1 S   H    _H1_     3     1.02780    87.68919   -82.29289
    4     1 S   H    _H2_     4     1.02957    74.63460    27.42120
    5     1 S   CT   _CA1     5     1.50120   155.23162   132.93998
    6     5 S   HC   _HA1     6     1.09575   105.22317    79.99795
    7     5 S   CO3  _C1_     7     1.53778   112.36049   -40.20922
    8     7 S   O2Z  _O11     8     1.26362   115.00252   -44.60207
    9     7 S   O2Z  _O12     9     1.26236   114.91321   134.51419
   10     5 S   CT   _CB1    10     1.53087   107.42771  -162.10908
   11    10 S   HC   HB11    11     1.09828   109.32037   -50.72789
   12    10 S   HC   HB12    12     1.09817   110.43187    65.81652
   13    10 S   CT   _CG1    13     1.53021   112.68026  -171.80696
   14    13 S   HC   HG11    14     1.09593   110.48782   -64.32447
   15    13 S   HC   HG12    15     1.09656   109.94639    54.91159
   16    13 S   C    _CD1    16     1.51819   112.26915   175.26335
   17    16 S   O    _OE1    17     1.22738   123.25450     0.17017
   18    16 S   N    _N2_    18     1.38640   111.70014  -179.71333
   19    18 S   H    _HN2    19     1.01587   119.10282     0.84302
   20    18 S   CT1  _CA2    20     1.46125   123.30672   179.46222
   21    20 S   HC   _HA2    21     1.09751   109.30207    -4.70919
   22    20 S   C    _C2_    22     1.53495   108.88962  -120.17610
   23    22 S   O    _O2_    23     1.23052   122.10924  -148.26259
   24    20 S   CT   _CB2    32     1.53466   111.71481   117.09853
   25    24 S   HC   HB21    33     1.09563   109.74517    55.89631
   26    24 S   HC   HB22    34     1.09371   109.62571   174.57545
   27    22 S   N    _N3_    24     1.38462   113.59636    39.47773
   28    27 S   H    _HN3    25     1.01494   118.99521    -0.88603
   29    24 S   S    _SG2    35     1.83736   111.27772   -64.88274
   30    27 S   CT   _CA3    26     1.45430   123.32836   174.56469
   31    30 S   HC   HA31    27     1.09529   109.14240    27.20401
   32    30 S   HC   HA32    28     1.09492   107.18422   144.21657
   33    29 S   CT   _C18    36     1.88426   102.02132  -169.13612
   34    33 S   OM   _O37    37     1.32325   106.37363   -54.84117
   35    30 S   CO3  _C3_    29     1.52925   113.03016   -96.16808
   36    35 S   O2Z  _O31    30     1.26408   115.36746   -45.76823
   37    35 S   O2Z  _O32    31     1.26348   115.00799   135.08694
   38    33 S   CT   _C19    38     1.55845   109.17369  -170.50092
   39    38 S   HC   _H5_    39     1.10327   108.70528    68.43481
   40    33 S   CT   _C17    70     1.55979   113.21681    64.25446
   41    40 S   HC   _H4_    71     1.09753   110.30274   -79.17340
   42    38 S   CO4  _C20    40     1.53471   113.81774  -175.76404
   43    42 S   O    _O33    41     1.23751   118.93232  -165.70434
   44    40 S   NP   _N5_    72     1.50914   110.32906    33.89047
   45    44 S   H    _H17    73     1.03070   111.21882    65.13622
   46    44 S   H    _H18    74     1.02781   110.72682   -53.40161
   47    44 S   H    _H19    75     1.02731   112.08945  -173.76288
   48    38 S   C    _C23    78     1.53420   113.40586   -51.12873
   49    48 S   O    _O36    79     1.22924   123.16229   -62.68131
   50    42 S   CT   _C21    42     1.55155   119.50120    17.80014
   51    48 S   N    _N4_    80     1.37513   114.09080   118.29916
   52    51 S   H    _H15    81     1.01435   122.71353    -0.89307
   53    51 S   H    _H16    82     1.01375   120.40263   179.48074
   54    50 S   CMA  _C22    43     1.54952   116.65239   -99.37640
   55    54 S   OM   _O34    44     1.26685   110.88141   -36.56486
   56    50 S   OH   _O35    76     1.44952   102.92944   144.71552
   57    56 S   HO   _H14    77     0.97476   106.03999    70.96182
   58    54 S   CM   _C13    45     1.36454   118.75105   144.03431
   59    58 S   CM   _C14    46     1.46863   124.49763     2.38925
   60    58 S   CO4  _C12    57     1.50592   118.74754   179.57942
   61    60 S   O    _O38    58     1.22535   124.23213   -26.41783
   62    59 S   CM   _C5_    47     1.35432   121.62913  -166.09321
   63    59 S   CT   _C15    65     1.51358   114.80755    13.27629
   64    63 S   HC   _H12    66     1.09779   108.83805    76.59121
   65    63 S   HC   _H13    67     1.09334   112.79263  -165.81164
   66    62 S   CA   _C6_    48     1.49019   119.52686     4.62914
   67    62 S   CT   _C4_    61     1.50980   123.53756  -175.49350
   68    67 S   HC   _H6_    62     1.09492   110.59014  -102.52241
   69    67 S   HC   _H7_    63     1.09269   113.31948    19.04717
   70    67 S   HC   _H8_    64     1.09614   110.97850   136.43653
   71    50 S   CT   _C16    68     1.53956   108.96908    32.72354
   72    71 S   HC   _H3_    69     1.10075   106.93110    68.26698
   73    66 S   CA   _C7_    49     1.40839   121.54185   165.68039
   74    73 S   HA   _H9_    50     1.08720   121.38637    -1.79220
   75    73 S   CA   _C8_    51     1.39715   121.52428   178.74212
   76    75 S   HA   _H10    52     1.08638   119.91436  -179.97202
   77    75 S   CA   _C9_    53     1.38829   120.05726     0.07402
   78    77 S   HA   _H11    54     1.08634   119.89654  -179.98022
   79    77 S   CA   _C10    55     1.39181   119.55021     0.43745
   80    66 S   CA   _C11    56     1.40549   120.70190   -14.66049
   81    79 S   OH   _O39    59     1.36965   115.89949   179.20771
   82    81 S   HO   _H20    60     0.97435   108.74037   177.99007
  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  10   5   4   3
  18   8   2   1   1  15   7  16   8  13   5   7   3   2   1   5
   3  12   2   1   1  12   5   5   1  12  15   9   3  14   6   3
   2  12   5   2   1   1   1   1   7   4   6   3   5   3   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    42    71    40    41    44    48  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    43    50    63    71    72    40    41    44    45    46    47    48    49    51  
   38    39    42    71    40    41    44    48  
   36    37  
   37  
    0  
   39    42    43    50    54    71    40    41    44    56    48    49    51    52    53  
   42    43    50    40    48    49    51  
   41    44    45    46    47    56    48    42    50    54    59    63    64    65    71    72  
   44    45    46    47    50    63    71    72  
   43    50    54    55    58    63    71    72    56    57    48    49    51  
   50    54    71    56    48  
   45    46    47    50    63    71    72  
   46    47    71  
   47    71  
   71  
   49    51    52    53    50  
   51    52    53  
   54    55    58    59    60    63    64    65    71    72    56    57  
   52    53  
   53  
    0  
   55    58    59    62    80    60    61    63    71    72    56    57  
   58    59    60    71    56  
   57    58    63    71    72  
   71  
   59    62    66    79    80    60    61    67    63    64    65    71  
   62    66    73    80    60    61    67    68    69    70    63    64    65    71    72  
   61    81    63    62    66    73    77    79    80  
   66    79    80  
   66    73    74    75    79    80    67    68    69    70    63    64    65    71  
   64    65    71    72    66    67  
   65    71    72  
   71    72  
   73    74    75    76    77    79    80    81    67    68    69    70  
   68    69    70    73    80  
   69    70  
   70  
    0  
   72  
    0  
   74    75    76    77    78    79    80  
   75    76    77    80  
   76    77    78    79    80    81  
   77    78    79  
   78    79    80    81    82  
   79    80    81  
   80    81    82  
   81    82  
   82  
    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  -0.175000   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   4.2000   0.3000  -0.012500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   40   3.5000   0.0660   0.250000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   42   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   44   3.2500   0.1700  -0.300000   2.1950   1.9500   0.003973653   1.685851020
   45   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   46   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   47   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   48   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   49   2.9600   0.2100  -0.500000   1.8100   1.6000   0.001000000  -1.480495490
   50   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   51   3.2500   0.1700  -0.760000   1.8100   1.6000   0.054801302  -1.445846770
   52   0.5000   0.0300   0.380000   1.5900   1.4000   0.030040813  -0.651083722
   53   0.5000   0.0300   0.380000   1.5900   1.4000   0.030040813  -0.651083722
   54   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   55   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   56   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   57   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   58   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   59   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   60   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   61   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   62   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   63   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   66   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   67   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   73   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   74   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   75   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   76   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   77   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   78   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   79   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   80   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   81   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   82   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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   570.000  1.307
   33    38   268.000  1.529
   33    40   268.000  1.529
   38    39   340.000  1.090
   38    42   317.000  1.522
   38    48   317.000  1.522
   42    43   570.000  1.229
   42    50   317.000  1.522
   50    54   270.000  1.512
   50    71   268.000  1.529
   50    56   320.000  1.410
   54    55   745.000  1.250
   54    58   465.000  1.376
   58    59   380.000  1.444
   58    60   320.000  1.462
   59    62   549.000  1.340
   59    63   317.000  1.510
   62    66   320.000  1.460
   62    67   317.000  1.510
   66    73   469.000  1.400
   66    80   469.000  1.400
   73    74   367.000  1.080
   73    75   469.000  1.400
   75    76   367.000  1.080
   75    77   469.000  1.400
   77    78   367.000  1.080
   77    79   469.000  1.400
   79    80   469.000  1.400
   79    81   450.000  1.364
   80    60   310.000  1.470
   60    61   570.000  1.229
   81    82   553.000  0.945
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    71   268.000  1.529
   71    72   340.000  1.090
   71    40   268.000  1.529
   40    41   340.000  1.090
   40    44   367.000  1.471
   44    45   434.000  1.010
   44    46   434.000  1.010
   44    47   434.000  1.010
   56    57   553.000  0.945
   48    49   570.000  1.229
   48    51   490.000  1.335
   51    52   434.000  1.010
   51    53   434.000  1.010
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    85.00000  114.68000
   29    33    38    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    42    63.00000  111.10000
   33    38    48    63.00000  111.10000
   33    40    71    58.35000  112.70000
   33    40    41    37.50000  110.70000
   33    40    44    80.00000  111.20000
   38    33    34    50.00000  109.50000
   38    42    43    80.00000  120.40000
   38    42    50    70.00000  116.00000
   38    48    49    80.00000  120.40000
   38    48    51    70.00000  116.60000
   42    38    39    35.00000  109.50000
   42    50    54    70.00000  109.06800
   42    50    71    63.00000  111.10000
   42    50    56    90.00000  109.61100
   50    42    43    80.00000  120.40000
   50    54    55    85.00000  112.85300
   50    54    58    65.00000  122.18000
   50    71    63    58.35000  112.70000
   50    71    72    37.50000  110.70000
   50    71    40    58.35000  112.70000
   50    56    57    55.00000  108.50000
   54    58    59    70.00000  117.34000
   54    58    60    60.00000  125.92000
   58    54    55    65.00000  137.10300
   58    59    62    70.00000  123.01800
   58    59    63    70.00000  124.00000
   58    60    80    65.00000  117.02400
   58    60    61    80.00000  123.72100
   59    62    66    60.00000  123.20500
   59    62    67    70.00000  124.00000
   59    63    64    35.00000  109.50000
   59    63    65    35.00000  109.50000
   59    63    71    70.00000  112.02700
   62    66    73    60.00000  120.93500
   62    66    80    60.00000  120.93500
   62    67    68    35.00000  109.50000
   62    67    69    35.00000  109.50000
   62    67    70    35.00000  109.50000
   66    73    74    35.00000  120.00000
   66    73    75    63.00000  120.00000
   66    80    79    63.00000  120.00000
   66    80    60    60.00000  119.52600
   73    75    76    35.00000  120.00000
   73    75    77    63.00000  120.00000
   75    73    74    35.00000  120.00000
   75    77    78    35.00000  120.00000
   75    77    79    63.00000  120.00000
   77    75    76    35.00000  120.00000
   77    79    80    63.00000  120.00000
   77    79    81    70.00000  120.00000
   79    77    78    35.00000  120.00000
   79    80    60    60.00000  119.52600
   79    81    82    35.00000  113.00000
   80    66    73    63.00000  120.00000
   80    60    61    75.00000  123.78400
   60    58    59    65.00000  118.96000
   81    79    80    70.00000  120.00000
   67    62    66    65.00000  118.87000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   63    59    62    70.00000  124.00000
   63    71    72    37.50000  110.70000
   63    71    40    58.35000  112.70000
   65    63    64    33.00000  107.80000
   71    50    54    70.00000  112.02700
   71    63    64    37.50000  110.70000
   71    63    65    37.50000  110.70000
   71    40    41    37.50000  110.70000
   71    40    44    80.00000  111.20000
   40    33    34    50.00000  109.50000
   40    33    38    58.35000  112.70000
   40    71    72    37.50000  110.70000
   40    44    45    35.00000  109.50000
   40    44    46    35.00000  109.50000
   40    44    47    35.00000  109.50000
   44    40    41    35.00000  109.50000
   46    44    45    35.00000  109.50000
   47    44    45    35.00000  109.50000
   47    44    46    35.00000  109.50000
   56    50    54    90.00000  110.39200
   56    50    71    50.00000  109.50000
   48    38    39    35.00000  109.50000
   48    38    42    70.00000  107.85200
   48    51    52    35.00000  119.80000
   48    51    53    35.00000  119.80000
   51    48    49    80.00000  122.90000
   53    51    52    35.00000  120.00000
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   0.13850  1.0 1.0
   24    29    33    34  -1.34450 -1.0 2.0
   24    29    33    34   0.57400  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
   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   0.15000  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
   29    33    38    48   0.56750  1.0 1.0
   29    33    38    48  -0.07550 -1.0 2.0
   29    33    38    48   0.20000  1.0 3.0
   29    33    40    71   0.44750  1.0 1.0
   29    33    40    71  -0.17800 -1.0 2.0
   29    33    40    71   0.20200  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    44   0.56750  1.0 1.0
   29    33    40    44  -0.07550 -1.0 2.0
   29    33    40    44   0.20000  1.0 3.0
   33    38    42    43   0.30150 -1.0 2.0
   33    38    42    50   0.60050  1.0 1.0
   33    38    42    50   0.05600 -1.0 2.0
   33    38    42    50   0.26150  1.0 3.0
   33    38    48    49   0.30150 -1.0 2.0
   33    38    48    51   1.39750  1.0 1.0
   33    38    48    51  -0.07950 -1.0 2.0
   33    38    48    51  -0.18750  1.0 3.0
   33    40    44    45   0.17350  1.0 3.0
   33    40    44    46   0.17350  1.0 3.0
   33    40    44    47   0.17350  1.0 3.0
   34    33    38    39   0.23400  1.0 3.0
   34    33    38    42  -0.09450  1.0 1.0
   34    33    38    42  -1.12950 -1.0 2.0
   34    33    38    42   0.54000  1.0 3.0
   34    33    38    48  -0.09450  1.0 1.0
   34    33    38    48  -1.12950 -1.0 2.0
   34    33    38    48   0.54000  1.0 3.0
   34    33    40    71   0.62750  1.0 1.0
   34    33    40    71  -0.30950 -1.0 2.0
   34    33    40    71   0.27300  1.0 3.0
   34    33    40    41   0.23400  1.0 3.0
   34    33    40    44   1.69300  1.0 1.0
   34    33    40    44  -0.48450 -1.0 2.0
   38    33    40    71   0.56750  1.0 1.0
   38    33    40    71  -0.07550 -1.0 2.0
   38    33    40    71   0.20000  1.0 3.0
   38    33    40    41   0.15000  1.0 3.0
   38    33    40    44   1.36600  1.0 1.0
   38    33    40    44  -0.11450 -1.0 2.0
   38    33    40    44   0.24250  1.0 3.0
   38    42    50    54   0.65300  1.0 1.0
   38    42    50    54  -0.03850 -1.0 2.0
   38    42    50    54   0.33900  1.0 3.0
   38    42   -50    71   0.60050  1.0 1.0
   38    42   -50    71   0.05600 -1.0 2.0
   38    42   -50    71   0.26150  1.0 3.0
   38    42    50    56   0.55300  1.0 1.0
   38    42    50    56   1.25850 -1.0 2.0
   38    42    50    56  -0.23600  1.0 3.0
   38    48    51    52   2.45000 -1.0 2.0
   38    48    51    53   2.45000 -1.0 2.0
   39    38    42    43   0.00000  1.0 1.0
   39    38    42    50   0.00000  1.0 1.0
   39    38    48    49   0.00000  1.0 1.0
   39    38    48    51   0.00000  1.0 1.0
   42    38    48    49   0.30150 -1.0 2.0
   42    38    48    51   0.00000  1.0 1.0
   42    50    54    55   0.09700  1.0 1.0
   42    50    54    55   0.15600 -1.0 2.0
   42    50    54    55  -0.50800  1.0 3.0
   42    50    54    58  -0.51250  1.0 1.0
   42    50    54    58  -0.88800 -1.0 2.0
   42    50    54    58   0.08850  1.0 3.0
   42    50    71    63  -0.95700  1.0 1.0
   42    50    71    63  -0.18200 -1.0 2.0
   42    50    71    63   0.29450  1.0 3.0
   42    50    71    72  -0.11250  1.0 3.0
   42    50    71    40  -0.95700  1.0 1.0
   42    50    71    40  -0.18200 -1.0 2.0
   42    50    71    40   0.29450  1.0 3.0
   42    50    56    57   0.91850  1.0 1.0
   42    50    56    57   0.57950  1.0 3.0
   43    42    50    54   0.30150 -1.0 2.0
   43    42    50    71   0.30150 -1.0 2.0
   43    42    50    56   0.30150 -1.0 2.0
   50    54    58    59   7.00000 -1.0 2.0
   50    54    58    60   7.00000 -1.0 2.0
   50    71   -40    33   0.56750  1.0 1.0
   50    71   -40    33  -0.07550 -1.0 2.0
   50    71   -40    33   0.20000  1.0 3.0
   50    71    40    41   0.15000  1.0 3.0
   50    71    40    44   1.36600  1.0 1.0
   50    71    40    44  -0.11450 -1.0 2.0
   50    71    40    44   0.24250  1.0 3.0
   54    50    71    63   0.34400  1.0 1.0
   54    50    71    63   0.09450 -1.0 2.0
   54    50    71    63   0.11100  1.0 3.0
   54    50    71    72   0.15000  1.0 3.0
   54    50    71    40   0.34400  1.0 1.0
   54    50    71    40   0.09450 -1.0 2.0
   54    50    71    40   0.11100  1.0 3.0
   54    50    56    57  -0.07800  1.0 1.0
   54    50    56    57  -0.21500 -1.0 2.0
   54    50    56    57  -0.03150  1.0 3.0
   54    58    59    62   0.28850  1.0 1.0
   54    58    59    62   2.61350 -1.0 2.0
   54    58    59    62   0.78400  1.0 3.0
   54    58   -59    63  -0.18600  1.0 3.0
   54    58    60    80  -1.65800  1.0 1.0
   54    58    60    80   0.77650 -1.0 2.0
   54    58    60    61   1.00000 -1.0 2.0
   55    54    58    59   7.00000 -1.0 2.0
   55    54    58    60   7.00000 -1.0 2.0
   58    59    62    66   7.00000 -1.0 2.0
   58    59    62    67   7.00000 -1.0 2.0
   58    59    63    64   0.00000  1.0 1.0
   58    59    63    65   0.00000  1.0 1.0
   58    59    63    71   0.98200  1.0 1.0
   58    59    63    71  -0.11900 -1.0 2.0
   58    59    63    71   0.24250  1.0 3.0
   59    58    60    80  -1.65800  1.0 1.0
   59    58    60    80   0.77650 -1.0 2.0
   59    58    60    61   1.00000 -1.0 2.0
   59    62    66    73   0.15800  1.0 1.0
   59    62    66    73   1.85350 -1.0 2.0
   59    62    66    73  -0.48700  1.0 3.0
   59    62   -66    80   0.15800  1.0 1.0
   59    62   -66    80   1.85350 -1.0 2.0
   59    62   -66    80  -0.48700  1.0 3.0
   59    62    67    68   0.00000  1.0 1.0
   59    62    67    69   0.00000  1.0 1.0
   59    62    67    70   0.00000  1.0 1.0
   59    63   -71    50   0.34400  1.0 1.0
   59    63   -71    50   0.09450 -1.0 2.0
   59    63   -71    50   0.11100  1.0 3.0
   59    63    71    72   0.15000  1.0 3.0
   59    63    71    40   0.34400  1.0 1.0
   59    63    71    40   0.09450 -1.0 2.0
   59    63    71    40   0.11100  1.0 3.0
   62    59    63    64   0.00000  1.0 1.0
   62    59    63    65   0.00000  1.0 1.0
   62    59    63    71   0.09850  1.0 1.0
   62    59    63    71   0.15250 -1.0 2.0
   62    59    63    71  -0.50650  1.0 3.0
   62    66    73    74   3.62500 -1.0 2.0
   62    66    73    75   3.62500 -1.0 2.0
   62    66    80    79   3.62500 -1.0 2.0
   62    66    80    60   3.62500 -1.0 2.0
   66    62    67    68   0.77000  1.0 3.0
   66    62    67    69   0.77000  1.0 3.0
   66    62    67    70   0.77000  1.0 3.0
   66    73    75    76   3.62500 -1.0 2.0
   66    73    75    77   3.62500 -1.0 2.0
   66    80   -60    58  -0.11500  1.0 1.0
   66    80   -60    58   1.10450 -1.0 2.0
   66    80   -60    58  -0.48050  1.0 3.0
   66    80    60    61   1.05000 -1.0 2.0
   73    66    80    79   3.62500 -1.0 2.0
   73    66    80    60   3.62500 -1.0 2.0
   73    75    77    78   3.62500 -1.0 2.0
   73    75   -77    79   3.62500 -1.0 2.0
   74    73    75    76   3.62500 -1.0 2.0
   74    73    75    77   3.62500 -1.0 2.0
   75    77    79    80   3.62500 -1.0 2.0
   75    77    79    81   3.62500 -1.0 2.0
   76    75    77    78   3.62500 -1.0 2.0
   76    75    77    79   3.62500 -1.0 2.0
   77    79   -80    66   3.62500 -1.0 2.0
   77    79    80    60   3.62500 -1.0 2.0
   77    79    81    82   0.84100 -1.0 2.0
   78    77    79    80   3.62500 -1.0 2.0
   78    77    79    81   3.62500 -1.0 2.0
   79    80    60    58  -0.11500  1.0 1.0
   79    80    60    58   1.10450 -1.0 2.0
   79    80    60    58  -0.48050  1.0 3.0
   79    80    60    61   1.05000 -1.0 2.0
   80    66    73    74   3.62500 -1.0 2.0
   80    66   -73    75   3.62500 -1.0 2.0
   80    79    81    82   0.84100 -1.0 2.0
   60    58   -59    62  -0.18600  1.0 3.0
   60    58    59    63   1.08500 -1.0 2.0
   81    79    80    66   3.62500 -1.0 2.0
   81    79    80    60   3.62500 -1.0 2.0
   67    62    66    73  -0.02500  1.0 1.0
   67    62    66    73  -0.32150 -1.0 2.0
   67    62    66    73  -0.01500  1.0 3.0
   67    62    66    80  -0.02500  1.0 1.0
   67    62    66    80  -0.32150 -1.0 2.0
   67    62    66    80  -0.01500  1.0 3.0
   63    59    62    66   7.00000 -1.0 2.0
   63    59    62    67   7.00000 -1.0 2.0
   63    71    40    33   0.56750  1.0 1.0
   63    71    40    33  -0.07550 -1.0 2.0
   63    71    40    33   0.20000  1.0 3.0
   63    71    40    41   0.15000  1.0 3.0
   63    71    40    44   1.36600  1.0 1.0
   63    71    40    44  -0.11450 -1.0 2.0
   63    71    40    44   0.24250  1.0 3.0
   64    63    71    50   0.15000  1.0 3.0
   64    63    71    72   0.15000  1.0 3.0
   64    63    71    40   0.15000  1.0 3.0
   65    63    71    50   0.15000  1.0 3.0
   65    63    71    72   0.15000  1.0 3.0
   65    63    71    40   0.15000  1.0 3.0
   71    50    54    55   0.09700  1.0 1.0
   71    50    54    55   0.15600 -1.0 2.0
   71    50    54    55  -0.50800  1.0 3.0
   71    50   -54    58   0.09850  1.0 1.0
   71    50   -54    58   0.15250 -1.0 2.0
   71    50   -54    58  -0.50650  1.0 3.0
   71    50    56    57  -0.11600  1.0 1.0
   71    50    56    57  -0.09450 -1.0 2.0
   71    50    56    57   0.21250  1.0 3.0
   71    40    44    45   0.17350  1.0 3.0
   71    40    44    46   0.17350  1.0 3.0
   71    40    44    47   0.17350  1.0 3.0
   72    71    40    33   0.15000  1.0 3.0
   72    71    40    41   0.15000  1.0 3.0
   72    71    40    44   0.19200  1.0 3.0
   40    33    38    39   0.15000  1.0 3.0
   40    33   -38    42  -0.95700  1.0 1.0
   40    33   -38    42  -0.18200 -1.0 2.0
   40    33   -38    42   0.29450  1.0 3.0
   40    33    38    48  -0.95700  1.0 1.0
   40    33    38    48  -0.18200 -1.0 2.0
   40    33    38    48   0.29450  1.0 3.0
   41    40    44    45   0.13050  1.0 3.0
   41    40    44    46   0.13050  1.0 3.0
   41    40    44    47   0.13050  1.0 3.0
   56    50    54    55   0.09700  1.0 1.0
   56    50    54    55   0.15600 -1.0 2.0
   56    50    54    55  -0.50800  1.0 3.0
   56    50    54    58   0.67800  1.0 1.0
   56    50    54    58   0.47050 -1.0 2.0
   56    50    54    58  -0.62500  1.0 3.0
   56    50    71    63   0.86500  1.0 1.0
   56    50    71    63  -0.17500 -1.0 2.0
   56    50    71    63   0.20800  1.0 3.0
   56    50    71    72   0.23400  1.0 3.0
   56    50    71    40   0.86500  1.0 1.0
   56    50    71    40  -0.17500 -1.0 2.0
   56    50    71    40   0.20800  1.0 3.0
   48    38    42    43   0.30150 -1.0 2.0
   48    38    42    50   0.65300  1.0 1.0
   48    38    42    50  -0.03850 -1.0 2.0
   48    38    42    50   0.33900  1.0 3.0
   49    48    51    52   2.45000 -1.0 2.0
   49    48    51    53   2.45000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   38    50    42    43  10.50000 -1.0 2.0
   50    55    54    58   1.10000 -1.0 2.0
   59    60    58    54   1.10000 -1.0 2.0
   58    63    59    62   1.10000 -1.0 2.0
   66    67    62    59   1.10000 -1.0 2.0
   73    80    66    62   4.00000 -1.0 2.0
   75    74    73    66   1.10000 -1.0 2.0
   77    76    75    73   1.10000 -1.0 2.0
   79    78    77    75   1.10000 -1.0 2.0
   80    81    79    77   4.00000 -1.0 2.0
   79    60    80    66   4.00000 -1.0 2.0
   58    80    60    61  10.50000 -1.0 2.0
   38    51    48    49  10.50000 -1.0 2.0
   53    48    51    52   1.00000 -1.0 2.0
END
