* LIGAND DATABASE FILE (OPLS2005)
*
001     107   111    210    341     634
    1     0 S   NP   _N1_     1    29.03158    93.68450   -19.02742
    2     1 S   H    _HN1     2     1.02781    72.16649   -91.00620
    3     1 S   H    _H1_     3     1.02954   101.09579    14.83685
    4     1 S   H    _H2_     4     1.02836    40.51868   118.27289
    5     1 S   CT   _CA1     5     1.50091   143.86106   165.60519
    6     5 S   HC   _HA1     6     1.09568   105.31088    28.70580
    7     5 S   CO3  _C1_     7     1.53886   112.14940   -91.69023
    8     7 S   O2Z  _O11     8     1.26371   115.03438   -49.15283
    9     7 S   O2Z  _O12     9     1.26227   114.90357   129.96030
   10     5 S   CT   _CB1    10     1.53081   107.43334   146.69622
   11    10 S   HC   HB11    11     1.09822   109.67875   -49.58173
   12    10 S   HC   HB12    12     1.09825   110.29011    67.03204
   13    10 S   CT   _CG1    13     1.52996   112.52283  -170.59755
   14    13 S   HC   HG11    14     1.09608   110.41439   -57.49209
   15    13 S   HC   HG12    15     1.09623   110.13348    61.75187
   16    13 S   C    _CD1    16     1.51756   112.11331  -177.68100
   17    16 S   O    _OE1    17     1.22736   123.27270    -7.08424
   18    16 S   N    _N2_    18     1.38599   111.62821   172.55342
   19    18 S   H    _HN2    19     1.01604   119.08355     3.50811
   20    18 S   CT1  _CA2    20     1.46305   123.33062  -175.24952
   21    20 S   HC   _HA2    21     1.09738   109.39694   -10.72383
   22    20 S   C    _C2_    22     1.53345   108.68938  -126.55467
   23    22 S   O    _O2_    23     1.23031   122.35890  -148.83504
   24    20 S   CT   _CB2    32     1.53944   111.03127   111.06374
   25    24 S   HC   HB21    33     1.09055   107.90634    56.91286
   26    24 S   HC   HB22    34     1.09174   109.56922   175.41371
   27    22 S   N    _N3_    24     1.38369   113.49392    38.78896
   28    27 S   H    _HN3    25     1.01649   119.49162    -3.81983
   29    24 S   S    _SG2    35     1.82916   110.22948   -63.89492
   30    27 S   CT   _CA3    26     1.45292   123.04848   176.83263
   31    30 S   HC   HA31    27     1.09555   107.54747   -62.97197
   32    30 S   HC   HA32    28     1.09560   107.90049    53.40189
   33    29 S   CT   _C24    36     1.97119   106.89681   174.19144
   34    30 S   CO3  _C3_    29     1.52916   114.20897   175.37310
   35    34 S   O2Z  _O31    30     1.26356   116.07771    -0.72820
   36    34 S   O2Z  _O32    31     1.26437   114.40716   179.32449
   37    33 S   CT   _C17    37     1.54803   109.93595   -28.50420
   38    37 S   HC   _H51    38     1.09286   110.04619  -173.23894
   39    33 S   CT   _C21    61     1.67008   109.09452    99.35301
   40    37 S   CO4  _C10    39     1.52070   115.36579   -58.34008
   41    40 S   O    _O33    40     1.22855   122.19071   145.37490
   42    39 S   CO4  _C8_    62     1.55708   116.71742  -150.90475
   43    42 S   O    _O29    63     1.22940   124.32112     7.73142
   44    39 S   CT   _C27    98     1.55175   108.54809   -34.63274
   45    44 S   HC   _H58    99     1.09311   112.62611    76.01439
   46    44 S   HC   _H59   100     1.09239   110.76559   -46.35695
   47    44 S   HC   _H60   101     1.08745   114.89112  -161.43207
   48    37 S   OH   _O38   106     1.41759   111.97826    69.83697
   49    48 S   HO   _H73   107     0.97320   107.58301   172.46644
   50    40 S   OS   _O36    41     1.35269   116.12978   -42.01373
   51    42 S   CT   _C12    64     1.52973   117.50704  -174.01326
   52    51 S   HC   _H42    65     1.09533   105.39623   176.60143
   53    51 S   HC   _H43    66     1.09053   111.00693   -69.53943
   54    50 S   CT   _C16    42     1.45188   122.78692    33.81993
   55    54 S   HC   _H50    43     1.09645   104.48710    80.93507
   56    51 S   CT   _C18    67     1.53548   111.14000    57.20102
   57    56 S   HC   _H52    68     1.10157   102.76536    53.59239
   58    54 S   C5BC _C7_    44     1.50981   109.28010  -168.09330
   59    33 S   CT   _C22    52     1.59531   103.87837  -141.37631
   60    95 S   CT   _C23    69     1.61038   119.24502  -154.21033
   61    56 S   CT   _C25    78     1.56855   114.32867   164.30377
   62    58 S   C5BC _C4_    45     1.42594   128.03035    36.17050
   63    62 S   HA   _H39    46     1.08083   127.42164     0.92387
   64    59 S   CT   _C15    53     1.56385   109.99103   -60.63841
   65    64 S   HC   _H48    54     1.09837   109.14965  -153.63243
   66    64 S   HC   _H49    55     1.09772   110.94209    91.60590
   67    60 S   CT   _C20    70     1.58386   115.61891    44.63592
   68    67 S   HC   _H54    71     1.09723   107.00122  -171.24447
   69    61 S   CT   _C30    79     1.53256   113.38003    68.92701
   70    69 S   HC   _H67    80     1.09704   110.57576  -173.59299
   71    69 S   HC   _H68    81     1.09225   111.76721    69.71220
   72    69 S   HC   _H69    82     1.09380   112.15513   -53.17917
   73    61 S   CT   _C31    83     1.54355   111.59220   -52.95295
   74    73 S   HC   _H70    84     1.09689   110.74765  -168.23258
   75    73 S   HC   _H71    85     1.09405   112.44524    71.37132
   76    73 S   HC   _H72    86     1.09582   110.97998   -50.53530
   77    60 S   CT   _C29    94     1.54798   111.10972   -73.82402
   78    77 S   HC   _H64    95     1.09436   111.31789    32.81081
   79    77 S   HC   _H65    96     1.08905   113.33714   -91.04268
   80    77 S   HC   _H66    97     1.09579   112.58153   150.66488
   81    59 S   CT   _C28   102     1.56545   111.40325   177.02494
   82    81 S   HC   _H61   103     1.09566   111.87100   -79.71297
   83    81 S   HC   _H62   104     1.09574   111.44476   160.95584
   84    81 S   HC   _H63   105     1.08880   114.25525    39.87989
   85    62 S   C5A  _C5_    47     1.37434   106.68485  -179.15189
   86    85 S   HA   _H40    48     1.08019   133.83206  -179.76930
   87    64 S   CT   _C14    56     1.54122   116.48725   -30.99594
   88    87 S   HC   _H46    57     1.09417   111.50626    93.80315
   89    87 S   HC   _H47    58     1.08688   104.35126  -152.68486
   90    67 S   CT   _C13    72     1.53024   114.07344    69.70020
   91    90 S   HC   _H44    73     1.09365   111.53992   -44.24651
   92    90 S   HC   _H45    74     1.09612   109.68929  -162.43706
   93    67 S   OS   _O39    87     1.44267   111.58759   -57.00647
   94    85 S   OA   _O35    49     1.35622   110.47506     0.63612
   95    87 S   CT   _C19    59     1.52596   111.48435   -30.27353
   96    95 S   HC   _H53    60     1.09299   101.68277   -45.42246
   97    90 S   CO4  _C9_    75     1.51489   112.68465    79.06720
   98    97 S   O    _O30    76     1.22586   122.62884   176.24735
   99    93 S   CO4  _C11    88     1.36291   118.32930  -151.67171
  100    99 S   O    _O34    89     1.22298   126.45345    -0.51282
  101    58 S   C5A  _C6_    50     1.38241   127.01217  -141.47081
  102   101 S   HA   _H41    51     1.08093   133.46980    -0.61739
  103    97 S   OS   _O37    77     1.35846   114.39852     1.61568
  104    99 S   CT   _C26    90     1.49833   109.40059   179.61999
  105   104 S   HC   _H55    91     1.09294   109.81577   -60.54970
  106   104 S   HC   _H56    92     1.09374   109.37459  -179.59266
  107   104 S   HC   _H57    93     1.09291   109.80850    61.31327
  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  13   5   4   3
  30   2   1   1  14   7  24   8   3  16   6   9   3   2   1   3
   1   8  12   5   4  17   6  24   8  10  13  22  15   6   4  11
   6   5  18   8   9   4   3   2   5   3   2   1   8   3   2   1
   4   2   1   1   4   2   4   3   2   8   5   4   8   2   1   1
   2   1   5   4   1   1   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    59    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    40    54    59    64    95    39    42    44    81    48  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    40    41    50    54    55    58    59    64    65    66    87    95    96    39    42    43    51    60    44    45    46    47    81    82    83    84    48    49  
   35    36  
   36  
    0  
   38    40    41    50    54    59    64    95    39    42    44    81    48    49  
   40    41    50    59    39    48    49  
   42    43    51    52    53    56    60    67    77    44    45    46    47    81    48    40    54    59    64    87    88    89    95    96  
   41    50    54    55    58    59    48    49  
   50    54    48  
   43    51    52    53    56    57    60    61    44    45    46    47    59    87    95    96  
   51    52    53    56    44    95  
   45    46    47    51    59    60    87    95    96  
   46    47    95  
   47    95  
   95  
   49    50    59  
    0  
   54    55    58    62   101    59    64    81  
   52    53    56    57    60    67   103    61    69    73    77    95  
   53    56    57    60    61  
   56    57    60    61  
   55    58    62    63    85    94   101   102    59    64    65    66    87    81    82    83    84  
   58    62   101    59    64    81  
   57    60    67    68    90    97   103    61    69    70    71    72    73    74    75    76    93    77    78    79    80    87    95    96  
   60    67   103    61    69    73    77    95  
   62    63    85    86    94   101   102    59    64    81  
   64    65    66    87    88    89    95    81    82    83    84    62   101  
   67    68    90    91    92    97   103    61    69    73    93    99    77    78    79    80    64    87    88    89    95    96  
   69    70    71    72    73    74    75    76    77    67    90    95    97    98   103  
   63    85    86    94   101   102  
   85    86    94   101  
   65    66    87    88    89    95    96    81    82    83    84  
   66    87    88    89    95    81  
   87    88    89    95    81  
   68    90    91    92    97    98   103    93    99   100   104    77    78    79    80    87    95    96  
   90    91    92    97    93    99    77    95  
   70    71    72    73    74    75    76    97   103  
   71    72    73   103  
   72    73   103  
   73   103  
   74    75    76    97   103  
   75    76   103  
   76   103  
  103  
   78    79    80    87    90    93    95    96  
   79    80    95  
   80    95  
   95  
   82    83    84    87  
   83    84  
   84  
    0  
   86    94   101   102  
   94   101  
   88    89    95    96  
   89    95    96  
   95    96  
   91    92    97    98   103    93    99    95  
   92    97    98   103    93  
   97    98   103    93  
   99   100   104   105   106   107    95    97  
  101   102  
   96  
    0  
   98   103  
  103  
  100   104   105   106   107  
  104   105   106   107  
  102  
    0  
    0  
  105   106   107  
  106   107  
  107  
    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   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   39   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   40   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   49   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   50   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   51   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   53   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   54   3.5000   0.0660   0.335000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   56   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5500   0.0760  -0.143000   2.0020   1.7750   0.001000000  -0.843144165
   59   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   60   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   61   3.5000   0.0660   0.250000   1.9750   1.7500   0.005000000  -0.741685710
   62   3.5500   0.0760  -0.154000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.126000   1.3810   1.2100   0.030040813   0.268726247
   64   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   69   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   86   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   87   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   92   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   93   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   94   2.9000   0.1400  -0.190000   1.6450   1.4500   0.001000000  -0.126889456
   95   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   98   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   99   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
  100   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
  101   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
  102   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
  103   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
  104   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  105   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  106   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  107   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   268.000  1.529
   33    59   268.000  1.529
   33    39   268.000  1.529
   37    38   340.000  1.090
   37    40   317.000  1.522
   37    48   320.000  1.410
   40    41   570.000  1.229
   40    50   214.000  1.327
   50    54   320.000  1.410
   54    55   340.000  1.090
   54    58   285.000  1.502
   54    59   268.000  1.529
   58    62   469.000  1.424
   58   101   546.000  1.367
   62    63   367.000  1.080
   62    85   546.000  1.367
   85    86   367.000  1.080
   85    94   340.000  1.360
   94   101   340.000  1.360
  101   102   367.000  1.080
   59    64   268.000  1.529
   59    81   268.000  1.529
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    87   268.000  1.529
   87    88   340.000  1.090
   87    89   340.000  1.090
   87    95   268.000  1.529
   95    96   340.000  1.090
   95    39   268.000  1.529
   95    60   268.000  1.529
   39    42   317.000  1.522
   39    44   268.000  1.529
   42    43   570.000  1.229
   42    51   317.000  1.522
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    56   268.000  1.529
   56    57   340.000  1.090
   56    60   268.000  1.529
   56    61   268.000  1.529
   60    67   268.000  1.529
   60    77   268.000  1.529
   67    68   340.000  1.090
   67    90   268.000  1.529
   67    93   320.000  1.410
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    97   317.000  1.522
   97    98   570.000  1.229
   97   103   214.000  1.327
  103    61   320.000  1.410
   61    69   268.000  1.529
   61    73   268.000  1.529
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   340.000  1.090
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    76   340.000  1.090
   93    99   214.000  1.327
   99   100   570.000  1.229
   99   104   317.000  1.522
  104   105   340.000  1.090
  104   106   340.000  1.090
  104   107   340.000  1.090
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    80   340.000  1.090
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   340.000  1.090
   81    82   340.000  1.090
   81    83   340.000  1.090
   81    84   340.000  1.090
   48    49   553.000  0.945
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  111.63000
   29    33    59    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    40    63.00000  111.10000
   33    37    48    50.00000  109.50000
   33    59    54    58.35000  112.70000
   33    59    64    58.35000  112.70000
   33    59    81    58.35000  112.70000
   33    39    95    58.35000  112.70000
   33    39    42    63.00000  111.10000
   33    39    44    58.35000  112.70000
   37    40    41    80.00000  120.40000
   37    40    50    81.00000  111.40000
   37    48    49    55.00000  108.50000
   40    37    38    35.00000  109.50000
   40    50    54    83.00000  116.90000
   50    40    41    83.00000  123.40000
   50    54    55    35.00000  109.50000
   50    54    58    85.00000  111.85700
   50    54    59    50.00000  109.50000
   54    58    62    60.00000  130.00000
   54    58   101    60.00000  130.00000
   54    59    64    58.35000  112.70000
   54    59    81    58.35000  112.70000
   58    54    55    35.00000  109.50000
   58    62    63    35.00000  127.50000
   58    62    85    70.00000  107.30000
   58   101    94    70.00000  110.60000
   58   101   102    35.00000  132.10000
   62    85    86    35.00000  132.10000
   62    85    94    70.00000  110.60000
   85    62    63    35.00000  125.70000
   85    94   101    70.00000  106.50000
   94    85    86    35.00000  113.40000
   94   101   102    35.00000  113.40000
  101    58    62    70.00000  107.30000
   59    33    37    58.35000  112.70000
   59    54    55    37.50000  110.70000
   59    54    58    70.00000  112.17500
   59    64    65    37.50000  110.70000
   59    64    66    37.50000  110.70000
   59    64    87    58.35000  112.70000
   59    81    82    37.50000  110.70000
   59    81    83    37.50000  110.70000
   59    81    84    37.50000  110.70000
   64    87    88    37.50000  110.70000
   64    87    89    37.50000  110.70000
   64    87    95    58.35000  112.70000
   66    64    65    33.00000  107.80000
   87    64    65    37.50000  110.70000
   87    64    66    37.50000  110.70000
   87    95    96    37.50000  110.70000
   87    95    39    58.35000  112.70000
   87    95    60    58.35000  112.70000
   89    87    88    33.00000  107.80000
   95    87    88    37.50000  110.70000
   95    87    89    37.50000  110.70000
   95    39    42    63.00000  111.10000
   95    39    44    58.35000  112.70000
   95    60    56    58.35000  112.70000
   95    60    67    58.35000  112.70000
   95    60    77    58.35000  112.70000
   39    33    37    58.35000  112.70000
   39    33    59    58.35000  112.70000
   39    95    96    37.50000  110.70000
   39    42    43    80.00000  120.40000
   39    42    51    70.00000  116.00000
   39    44    45    37.50000  110.70000
   39    44    46    37.50000  110.70000
   39    44    47    37.50000  110.70000
   42    51    52    35.00000  109.50000
   42    51    53    35.00000  109.50000
   42    51    56    63.00000  111.10000
   51    42    43    80.00000  120.40000
   51    56    57    37.50000  110.70000
   51    56    60    58.35000  112.70000
   51    56    61    58.35000  112.70000
   53    51    52    33.00000  107.80000
   56    51    52    37.50000  110.70000
   56    51    53    37.50000  110.70000
   56    60    67    58.35000  112.70000
   56    60    77    58.35000  112.70000
   56    61   103    50.00000  109.50000
   56    61    69    58.35000  112.70000
   56    61    73    58.35000  112.70000
   60    95    96    37.50000  110.70000
   60    95    39    58.35000  112.70000
   60    56    57    37.50000  110.70000
   60    67    68    37.50000  110.70000
   60    67    90    58.35000  112.70000
   60    67    93    50.00000  109.50000
   60    77    78    37.50000  110.70000
   60    77    79    37.50000  110.70000
   60    77    80    37.50000  110.70000
   67    90    91    37.50000  110.70000
   67    90    92    37.50000  110.70000
   67    90    97    63.00000  111.10000
   67    93    99    83.00000  116.90000
   90    67    68    37.50000  110.70000
   90    97    98    80.00000  120.40000
   90    97   103    81.00000  111.40000
   92    90    91    33.00000  107.80000
   97    90    91    35.00000  109.50000
   97    90    92    35.00000  109.50000
   97   103    61    83.00000  116.90000
  103    97    98    83.00000  123.40000
  103    61    69    50.00000  109.50000
  103    61    73    50.00000  109.50000
   61    56    57    37.50000  110.70000
   61    56    60    58.35000  112.70000
   61    69    70    37.50000  110.70000
   61    69    71    37.50000  110.70000
   61    69    72    37.50000  110.70000
   61    73    74    37.50000  110.70000
   61    73    75    37.50000  110.70000
   61    73    76    37.50000  110.70000
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    33.00000  107.80000
   73    61    69    58.35000  112.70000
   75    73    74    33.00000  107.80000
   76    73    74    33.00000  107.80000
   76    73    75    33.00000  107.80000
   93    67    68    35.00000  109.50000
   93    67    90    50.00000  109.50000
   93    99   100    83.00000  123.40000
   93    99   104    81.00000  111.40000
   99   104   105    35.00000  109.50000
   99   104   106    35.00000  109.50000
   99   104   107    35.00000  109.50000
  104    99   100    80.00000  120.40000
  106   104   105    33.00000  107.80000
  107   104   105    33.00000  107.80000
  107   104   106    33.00000  107.80000
   77    60    67    58.35000  112.70000
   79    77    78    33.00000  107.80000
   80    77    78    33.00000  107.80000
   80    77    79    33.00000  107.80000
   44    39    42    63.00000  111.10000
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    33.00000  107.80000
   81    59    64    58.35000  112.70000
   83    81    82    33.00000  107.80000
   84    81    82    33.00000  107.80000
   84    81    83    33.00000  107.80000
   48    37    38    35.00000  109.50000
   48    37    40    90.00000  109.61100
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
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   60    95    39    44   0.20000  1.0 3.0
   60    56    61   103   0.62750  1.0 1.0
   60    56    61   103  -0.30950 -1.0 2.0
   60    56    61   103   0.27300  1.0 3.0
   60    56    61    69   0.56750  1.0 1.0
   60    56    61    69  -0.07550 -1.0 2.0
   60    56    61    69   0.20000  1.0 3.0
   60    56    61    73   0.56750  1.0 1.0
   60    56    61    73  -0.07550 -1.0 2.0
   60    56    61    73   0.20000  1.0 3.0
   60    67    90    91   0.15000  1.0 3.0
   60    67    90    92   0.15000  1.0 3.0
   60    67    90    97  -0.95700  1.0 1.0
   60    67    90    97  -0.18200 -1.0 2.0
   60    67    90    97   0.29450  1.0 3.0
   60    67    93    99  -0.25900  1.0 1.0
   60    67    93    99  -0.47000 -1.0 2.0
   60    67    93    99   0.11750  1.0 3.0
   67    60    77    78   0.15000  1.0 3.0
   67    60    77    79   0.15000  1.0 3.0
   67    60    77    80   0.15000  1.0 3.0
   67    90    97    98   0.30150 -1.0 2.0
   67    90    97   103   0.36750  1.0 3.0
   67    93    99   100   3.00000 -1.0 2.0
   67    93    99   104   1.63150  1.0 1.0
   67    93    99   104   2.92000 -1.0 2.0
   68    67    90    91   0.15000  1.0 3.0
   68    67    90    92   0.15000  1.0 3.0
   68    67    90    97  -0.11250  1.0 3.0
   68    67    93    99   0.08050  1.0 3.0
   90    67    93    99  -0.25900  1.0 1.0
   90    67    93    99  -0.47000 -1.0 2.0
   90    67    93    99   0.11750  1.0 3.0
   90    97   103    61   1.63150  1.0 1.0
   90    97   103    61   2.92000 -1.0 2.0
   91    90    97    98   0.00000  1.0 1.0
   91    90    97   103   0.00000  1.0 1.0
   92    90    97    98   0.00000  1.0 1.0
   92    90    97   103   0.00000  1.0 1.0
   97   103    61    56  -0.25900  1.0 1.0
   97   103    61    56  -0.47000 -1.0 2.0
   97   103    61    56   0.11750  1.0 3.0
   97   103    61    69  -0.25900  1.0 1.0
   97   103    61    69  -0.47000 -1.0 2.0
   97   103    61    69   0.11750  1.0 3.0
   97   103    61    73  -0.25900  1.0 1.0
   97   103    61    73  -0.47000 -1.0 2.0
   97   103    61    73   0.11750  1.0 3.0
   98    97   103    61   3.00000 -1.0 2.0
  103    61    69    70   0.23400  1.0 3.0
  103    61    69    71   0.23400  1.0 3.0
  103    61    69    72   0.23400  1.0 3.0
  103    61    73    74   0.23400  1.0 3.0
  103    61    73    75   0.23400  1.0 3.0
  103    61    73    76   0.23400  1.0 3.0
   61    56    60    95   0.56750  1.0 1.0
   61    56    60    95  -0.07550 -1.0 2.0
   61    56    60    95   0.20000  1.0 3.0
   61    56    60    67   0.56750  1.0 1.0
   61    56    60    67  -0.07550 -1.0 2.0
   61    56    60    67   0.20000  1.0 3.0
   61    56    60    77   0.56750  1.0 1.0
   61    56    60    77  -0.07550 -1.0 2.0
   61    56    60    77   0.20000  1.0 3.0
   69    61    73    74   0.15000  1.0 3.0
   69    61    73    75   0.15000  1.0 3.0
   69    61    73    76   0.15000  1.0 3.0
   73    61    69    70   0.15000  1.0 3.0
   73    61    69    71   0.15000  1.0 3.0
   73    61    69    72   0.15000  1.0 3.0
   93    67    90    91   0.23400  1.0 3.0
   93    67    90    92   0.23400  1.0 3.0
   93    67    90    97  -0.09450  1.0 1.0
   93    67    90    97  -1.12950 -1.0 2.0
   93    67    90    97   0.54000  1.0 3.0
   93    99   104   105   0.00000  1.0 1.0
   93    99   104   106   0.00000  1.0 1.0
   93    99   104   107   0.00000  1.0 1.0
  100    99   104   105   0.00000  1.0 1.0
  100    99   104   106   0.00000  1.0 1.0
  100    99   104   107   0.00000  1.0 1.0
   77    60    67    68   0.15000  1.0 3.0
   77    60    67    90   0.56750  1.0 1.0
   77    60    67    90  -0.07550 -1.0 2.0
   77    60    67    90   0.20000  1.0 3.0
   77    60    67    93   0.62750  1.0 1.0
   77    60    67    93  -0.30950 -1.0 2.0
   77    60    67    93   0.27300  1.0 3.0
   44    39    42    43   0.30150 -1.0 2.0
   44    39    42    51   0.60050  1.0 1.0
   44    39    42    51   0.05600 -1.0 2.0
   44    39    42    51   0.26150  1.0 3.0
   81    59    64    65   0.15000  1.0 3.0
   81    59    64    66   0.15000  1.0 3.0
   81    59    64    87   0.56750  1.0 1.0
   81    59    64    87  -0.07550 -1.0 2.0
   81    59    64    87   0.20000  1.0 3.0
   48    37    40    41   0.30150 -1.0 2.0
   48    37    40    50   0.30750  1.0 1.0
   48    37    40    50   1.13850 -1.0 2.0
   48    37    40    50   0.38850  1.0 3.0
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
   37    50    40    41  10.50000 -1.0 2.0
   62   101    58    54   4.00000 -1.0 2.0
   85    63    62    58   1.10000 -1.0 2.0
   94    86    85    62   1.10000 -1.0 2.0
   94   102   101    58   1.10000 -1.0 2.0
   39    51    42    43  10.50000 -1.0 2.0
   90   103    97    98  10.50000 -1.0 2.0
   93   104    99   100  10.50000 -1.0 2.0
END
