* LIGAND DATABASE FILE (OPLS2005)
*
001     107   111    206    344     625
    1     0 S   NP   _N1_     1    28.45665    97.64745   -23.06931
    2     1 S   H    _HN1     2     1.02958    71.95699    -3.85778
    3     1 S   H    _H1_     3     1.02834    37.85539   153.30926
    4     1 S   H    _H2_     4     1.02781   106.28546  -108.29585
    5     1 S   CT   _CA1     5     1.50128   137.61273    96.89796
    6     5 S   HC   _HA1     6     1.09575   105.21343    92.25867
    7     5 S   CO3  _C1_     7     1.53777   112.39861   -27.93840
    8     7 S   O2Z  _O11     8     1.26363   114.99980   -43.43476
    9     7 S   O2Z  _O12     9     1.26237   114.93070   135.66983
   10     5 S   CT   _CB1    10     1.53079   107.41324  -149.83064
   11    10 S   HC   HB11    11     1.09829   109.31074   -50.53730
   12    10 S   HC   HB12    12     1.09817   110.42663    66.00621
   13    10 S   CT   _CG1    13     1.53020   112.69499  -171.61238
   14    13 S   HC   HG11    14     1.09591   110.51407   -64.80223
   15    13 S   HC   HG12    15     1.09656   109.91801    54.43378
   16    13 S   C    _CD1    16     1.51812   112.25776   174.78368
   17    16 S   O    _OE1    17     1.22745   123.26205     1.09985
   18    16 S   N    _N2_    18     1.38593   111.74831  -178.92918
   19    18 S   H    _HN2    19     1.01570   119.05955     3.68706
   20    18 S   CT1  _CA2    20     1.45924   122.78582   177.67864
   21    20 S   HC   _HA2    21     1.09654   110.04540    20.71635
   22    20 S   C    _C2_    22     1.52688   104.51178   -96.85854
   23    22 S   O    _O2_    23     1.23037   122.43512   -81.53598
   24    20 S   CT   _CB2    32     1.53190   111.81078   144.12716
   25    24 S   HC   HB21    33     1.09574   110.46006    51.10132
   26    24 S   HC   HB22    34     1.09438   109.49879   169.83032
   27    22 S   N    _N3_    24     1.38429   113.09966    94.03412
   28    27 S   H    _HN3    25     1.01697   120.21729     0.52339
   29    24 S   S    _SG2    35     1.82906   110.85874   -68.83163
   30    27 S   CT   _CA3    26     1.45336   122.36257  -178.07929
   31    30 S   HC   HA31    27     1.09572   107.55187   -60.10695
   32    30 S   HC   HA32    28     1.09572   107.80025    56.12721
   33    29 S   CT   _C22    36     1.85387   101.21723  -165.31058
   34    30 S   CO3  _C3_    29     1.52854   114.55700   177.89895
   35    34 S   O2Z  _O31    30     1.26301   116.16266    -4.75110
   36    34 S   O2Z  _O32    31     1.26464   114.36295   175.41379
   37    33 S   CM   _C13    37     1.55826   118.01123    69.13753
   38    33 S   CT   _C21    66     1.58090   111.91201  -167.48075
   39    33 S   OH   _O34   106     1.44356   105.45799   -52.78895
   40    39 S   HO   _H14   107     0.97149   107.27405    73.81196
   41    37 S   CMA  _C12    38     1.37202   128.06776    21.86934
   42    41 S   OM   _O38    39     1.26584   126.73611    -9.40732
   43    38 S   OH   _O35    67     1.44025   108.90523    55.05014
   44    43 S   HO   _H15    68     0.97506   106.88012   -49.74542
   45    41 S   CA   _C11    40     1.54193   115.56103   165.54054
   46    45 S   CA   _C6_    41     1.41293   121.37526    18.43768
   47    46 S   CA   _C7_    42     1.41288   120.73516  -179.46186
   48    47 S   HA   _H9_    43     1.08774   120.44954  -178.69764
   49    46 S   CT   _C5_    51     1.50858   119.64837     3.66992
   50    47 S   CA   _C8_    44     1.38889   121.34302     0.72820
   51    50 S   HA   _H10    45     1.08552   120.30497   179.84051
   52    37 S   CT   _C14    52     1.53005   109.03798  -165.68170
   53    52 S   HC   _H3_    53     1.09757   110.30168    44.45250
   54    49 S   CT   _C4_   100     1.54123   108.59936    87.26496
   55    54 S   HC   _H6_   101     1.09632   110.84313   178.75212
   56    54 S   HC   _H7_   102     1.09694   110.89333    61.16385
   57    54 S   HC   _H8_   103     1.09517   112.66354   -59.87447
   58    49 S   OH   _O40   104     1.43187   110.78650  -155.44494
   59    58 S   HO   _H36   105     0.97237   107.94938  -177.00415
   60    50 S   CA   _C9_    46     1.38363   119.27550    -0.90049
   61    60 S   HA   _H11    47     1.08661   119.76591  -179.31700
   62    52 S   CT   _C15    54     1.53879   106.78605   -69.53632
   63    62 S   HC   _H12    55     1.09682   110.15411   178.77475
   64    62 S   HC   _H13    56     1.09617   109.64591   -64.51324
   65    45 S   CA   _C10    48     1.42266   122.61489  -161.21519
   66    62 S   CT   _C16    57     1.55973   111.17959    59.21560
   67    66 S   HC   _H4_    58     1.09656   105.65348    66.12902
   68    65 S   OH   _O39    49     1.37453   123.34698    -1.42038
   69    68 S   HO   _H35    50     0.97573   107.12252    -5.12919
   70    66 S   CT   _C17    59     1.55693   110.36570  -177.70424
   71    70 S   HC   _H5_    60     1.10100   107.59932   -52.16471
   72    70 S   CMA  _C18    61     1.53762   109.78850    68.22228
   73    72 S   OM   _O37    62     1.26610   110.84077  -143.46246
   74    70 S   NP   _N6_    90     1.55800   109.17305  -165.11052
   75    74 S   H    _H28    91     1.03025   106.25968   -41.14224
   76    72 S   CM   _C19    63     1.35462   118.68389    34.98475
   77    74 S   CT   _C29    92     1.50992   112.63610    75.51611
   78    77 S   HC   _H29    93     1.09318   108.50559    62.42059
   79    77 S   HC   _H30    94     1.09362   108.13142  -177.33464
   80    77 S   HC   _H31    95     1.09042   109.24880   -58.91483
   81    74 S   CT   _C30    96     1.50836   115.14543  -157.97903
   82    81 S   HC   _H32    97     1.09280   108.78234   -59.90319
   83    81 S   HC   _H33    98     1.09222   108.78593    62.69022
   84    81 S   HC   _H34    99     1.09400   108.02446  -179.79537
   85    76 S   CO4  _C20    64     1.49585   123.32921     0.09065
   86    85 S   O    _O33    65     1.23166   117.96456   164.49123
   87    76 S   C    _C23    69     1.49380   118.13775   178.04776
   88    87 S   O    _O36    70     1.22707   121.38764  -108.30911
   89    87 S   N    _N4_    71     1.38130   112.87809    74.45433
   90    89 S   H    _H16    72     1.01571   119.41511    -3.17213
   91    89 S   CT   _C24    73     1.43950   122.02736  -179.57067
   92    91 S   HC   _H17    74     1.09418   109.67921   169.38477
   93    91 S   HC   _H18    75     1.09476   109.51644    47.44866
   94    91 S   NP   _N5_    76     1.49719   110.48446   -70.80501
   95    94 S   H    _H19    77     1.02967   105.91315    56.91797
   96    94 S   CT   _C25    78     1.51215   114.72928   -60.59991
   97    96 S   HC   _H20    79     1.09309   108.53720    87.10031
   98    96 S   HC   _H21    80     1.09517   108.01252   -33.51970
   99    96 S   CT   _C26    81     1.51314   103.35615  -151.86924
  100    99 S   HC   _H22    82     1.09641   110.52130   -78.40049
  101    99 S   HC   _H23    83     1.09349   112.34335   160.49525
  102    99 S   CT   _C27    84     1.51511   102.55033    39.37137
  103   102 S   HC   _H24    85     1.09677   110.11894    76.95869
  104   102 S   HC   _H25    86     1.09373   112.62904  -162.63063
  105    94 S   CT   _C28    87     1.51516   114.33449   174.54310
  106   105 S   HC   _H26    88     1.09414   109.93697     5.61709
  107   105 S   HC   _H27    89     1.09454   106.60989  -113.85300
  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
  19   2   1   1  19  19   6   1  11   4   8   2  13  17  10   4
  14   5   3  13   6   6   3   2   1   2   1   4   2   9   4   3
   2  12   5   1   1  16   7  11   4  10   8   7   7   3   2   1
   3   2   1   1   4   1   7   3   8   4  12   5   4  13   8  11
   6   5   8   5   4   5   4   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    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    41    52    66    85    38    43    39    40  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    41    42    45    49    52    53    62    66    67    70    76    85    86    38    43    44    39    40  
   35    36  
   36  
    0  
   41    42    45    46    65    49    52    53    62    63    64    66    85    38    43    54    58    39    40  
   43    44    87    74    39    40    41    52    62    63    64    66    67    70    71    72    76    85    86  
   40    41    43    52    66    85  
    0  
   42    45    46    47    60    65    68    49    52    53    62  
   45    46    65    52  
   44    62    66    67    70    76    85    86  
   66    85  
   46    47    48    50    60    61    65    68    69    49    52    54    58  
   47    48    50    51    60    65    68    49    52    53    62    54    55    56    57    58    59  
   48    50    51    60    61    65    49    52    54    58  
   50    51    60    49  
   52    53    62    63    64    66    54    55    56    57    58    59    50    65  
   51    60    61    65    68  
   60    61    65  
   53    62    63    64    66    67    70    54    55    56    57    58    59  
   62    63    64    66    54    58  
   55    56    57    58    59    62  
   56    57    58  
   57    58  
   58  
   59    62  
    0  
   61    65    68    69  
   65    68  
   63    64    66    67    70    71    72    85    74  
   64    66    67    70  
   66    67    70  
   68    69  
   67    70    71    72    73    76    85    86    74    75    77    81  
   70    71    72    85    74  
   69  
    0  
   71    72    73    76    85    87    74    75    77    78    79    80    81    82    83    84  
   72    73    76    74    75    77    81  
   73    76    85    86    87    88    89    74    75    77    81  
   76    85    87    74  
   75    77    78    79    80    81    82    83    84    76  
   77    78    79    80    81    82    83    84  
   85    86    87    88    89    90    91  
   78    79    80    81    82    83    84  
   79    80    81  
   80    81  
   81  
   82    83    84  
   83    84  
   84  
    0  
   86    87    88    89  
   87  
   88    89    90    91    92    93    94  
   89    90    91  
   90    91    92    93    94    95    96   105  
   91    92    93    94  
   92    93    94    95    96    97    98    99   102   105   106   107  
   93    94    95    96   105  
   94    95    96   105  
   95    96    97    98    99   100   101   102   103   104   105   106   107  
   96    97    98    99   102   105   106   107  
   97    98    99   100   101   102   103   104   105   106   107  
   98    99   100   101   102   105  
   99   100   101   102   105  
  100   101   102   103   104   105   106   107  
  101   102   103   104   105  
  102   103   104   105  
  103   104   105   106   107  
  104   105   106   107  
  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   0.432500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   39   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   40   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   41   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   44   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   45   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   46   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   48   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   49   3.5000   0.0660   0.380000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   59   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   60   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   61   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   62   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   65   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   66   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   68   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   69   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   70   3.5000   0.0660   0.210000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   72   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   73   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   74   3.2500   0.1700  -0.100000   2.1950   1.9500   0.003973653   1.685851020
   75   0.5000   0.0300   0.290000   0.9960   0.8600   0.030040813  -0.651083722
   76   3.5500   0.0760  -0.657900   2.0020   1.7750   0.023028004  -0.852763146
   77   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   79   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   80   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   81   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   83   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   84   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   85   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   86   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   87   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   88   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   89   3.2500   0.1700  -0.422500   1.8100   1.6000   0.054801302  -1.445846770
   90   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   91   3.5000   0.0660   0.272500   1.9750   1.7500   0.005000000  -0.741685710
   92   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   93   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   94   3.2500   0.1700  -0.100000   2.2900   2.0360   0.003973653   1.685851020
   95   0.5000   0.0300   0.290000   0.9960   0.8600   0.030040813  -0.651083722
   96   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   98   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   99   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  100   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  101   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  102   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  103   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  104   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  105   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
  106   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  107   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    38   268.000  1.529
   33    39   320.000  1.410
   37    41   465.000  1.376
   37    52   317.000  1.510
   41    42   745.000  1.250
   41    45   320.000  1.460
   45    46   469.000  1.400
   45    65   469.000  1.400
   46    47   469.000  1.400
   46    49   317.000  1.510
   47    48   367.000  1.080
   47    50   469.000  1.400
   50    51   367.000  1.080
   50    60   469.000  1.400
   60    61   367.000  1.080
   60    65   469.000  1.400
   65    68   450.000  1.364
   68    69   553.000  0.945
   49    52   268.000  1.529
   49    54   268.000  1.529
   49    58   320.000  1.410
   52    53   340.000  1.090
   52    62   268.000  1.529
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    66   268.000  1.529
   66    67   340.000  1.090
   66    70   268.000  1.529
   66    38   268.000  1.529
   70    71   340.000  1.090
   70    72   270.000  1.512
   70    74   367.000  1.471
   72    73   745.000  1.250
   72    76   465.000  1.376
   76    85   320.000  1.462
   76    87   410.000  1.444
   85    86   570.000  1.229
   85    38   317.000  1.522
   38    43   320.000  1.410
   43    44   553.000  0.945
   87    88   570.000  1.229
   87    89   490.000  1.335
   89    90   434.000  1.010
   89    91   337.000  1.449
   91    92   340.000  1.090
   91    93   340.000  1.090
   91    94   367.000  1.471
   94    95   434.000  1.010
   94    96   367.000  1.471
   94   105   367.000  1.471
   96    97   340.000  1.090
   96    98   340.000  1.090
   96    99   268.000  1.529
   99   100   340.000  1.090
   99   101   340.000  1.090
   99   102   268.000  1.529
  102   103   340.000  1.090
  102   104   340.000  1.090
  102   105   268.000  1.529
  105   106   340.000  1.090
  105   107   340.000  1.090
   74    75   434.000  1.010
   74    77   367.000  1.471
   74    81   367.000  1.471
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    80   340.000  1.090
   81    82   340.000  1.090
   81    83   340.000  1.090
   81    84   340.000  1.090
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   340.000  1.090
   58    59   553.000  0.945
   39    40   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  112.20000
   29    33    38    75.00000  111.63000
   29    33    39    85.00000  114.68000
   33    37    41    70.00000  124.00000
   33    37    52    65.00000  117.92700
   33    38    66    58.35000  112.70000
   33    38    85    63.00000  111.10000
   33    38    43    50.00000  109.50000
   33    39    40    55.00000  108.50000
   37    41    42    65.00000  137.10300
   37    41    45    60.00000  123.20500
   37    52    49    70.00000  112.02700
   37    52    53    35.00000  109.50000
   37    52    62    70.00000  112.02700
   41    45    46    60.00000  120.93500
   41    45    65    60.00000  120.93500
   45    41    42    85.00000  114.86500
   45    46    47    63.00000  120.00000
   45    46    49    70.00000  120.00000
   45    65    60    63.00000  120.00000
   45    65    68    70.00000  120.00000
   46    47    48    35.00000  120.00000
   46    47    50    63.00000  120.00000
   46    49    52    70.00000  112.17500
   46    49    54    70.00000  112.17500
   46    49    58    90.00000  112.51600
   47    50    51    35.00000  120.00000
   47    50    60    63.00000  120.00000
   50    47    48    35.00000  120.00000
   50    60    61    35.00000  120.00000
   50    60    65    63.00000  120.00000
   60    50    51    35.00000  120.00000
   60    65    68    70.00000  120.00000
   65    45    46    63.00000  120.00000
   65    60    61    35.00000  120.00000
   65    68    69    35.00000  113.00000
   49    46    47    70.00000  120.00000
   49    52    53    37.50000  110.70000
   49    52    62    58.35000  112.70000
   49    54    55    37.50000  110.70000
   49    54    56    37.50000  110.70000
   49    54    57    37.50000  110.70000
   49    58    59    55.00000  108.50000
   52    37    41    70.00000  124.00000
   52    62    63    37.50000  110.70000
   52    62    64    37.50000  110.70000
   52    62    66    58.35000  112.70000
   62    52    53    37.50000  110.70000
   62    66    67    37.50000  110.70000
   62    66    70    58.35000  112.70000
   62    66    38    58.35000  112.70000
   64    62    63    33.00000  107.80000
   66    62    63    37.50000  110.70000
   66    62    64    37.50000  110.70000
   66    70    71    37.50000  110.70000
   66    70    72    70.00000  112.02700
   66    70    74    80.00000  111.20000
   66    38    85    63.00000  111.10000
   66    38    43    50.00000  109.50000
   70    66    67    37.50000  110.70000
   70    72    73    85.00000  112.85300
   70    72    76    65.00000  122.18000
   70    74    75    35.00000  109.50000
   70    74    77    75.00000  113.01200
   70    74    81    75.00000  113.01200
   72    70    71    45.00000  110.52000
   72    76    85    60.00000  125.92000
   72    76    87    60.00000  120.04000
   76    72    73    65.00000  137.10300
   76    85    86    80.00000  123.72100
   76    85    38    65.00000  118.62400
   76    87    88    80.00000  125.30000
   76    87    89    80.00000  111.56200
   85    38    43    90.00000  109.61100
   38    33    37    70.00000  112.02700
   38    66    67    37.50000  110.70000
   38    66    70    58.35000  112.70000
   38    85    86    80.00000  120.40000
   38    43    44    55.00000  108.50000
   87    76    85    55.00000  123.68000
   87    89    90    35.00000  119.80000
   87    89    91    50.00000  121.90000
   89    87    88    80.00000  122.90000
   89    91    92    35.00000  109.50000
   89    91    93    35.00000  109.50000
   89    91    94    80.00000  116.76000
   91    89    90    38.00000  118.40000
   91    94    95    35.00000  109.50000
   91    94    96    75.00000  113.01200
   91    94   105    75.00000  113.01200
   93    91    92    33.00000  107.80000
   94    91    92    35.00000  109.50000
   94    91    93    35.00000  109.50000
   94    96    97    35.00000  109.50000
   94    96    98    35.00000  109.50000
   94    96    99    80.00000  111.20000
   94   105   102    80.00000  111.20000
   94   105   106    35.00000  109.50000
   94   105   107    35.00000  109.50000
   96    94    95    35.00000  109.50000
   96    99   100    37.50000  110.70000
   96    99   101    37.50000  110.70000
   96    99   102    58.35000  112.70000
   98    96    97    33.00000  107.80000
   99    96    97    37.50000  110.70000
   99    96    98    37.50000  110.70000
   99   102   103    37.50000  110.70000
   99   102   104    37.50000  110.70000
   99   102   105    58.35000  112.70000
  101    99   100    33.00000  107.80000
  102    99   100    37.50000  110.70000
  102    99   101    37.50000  110.70000
  102   105   106    37.50000  110.70000
  102   105   107    37.50000  110.70000
  104   102   103    33.00000  107.80000
  105    94    95    35.00000  109.50000
  105    94    96    75.00000  113.01200
  105   102   103    37.50000  110.70000
  105   102   104    37.50000  110.70000
  107   105   106    33.00000  107.80000
   74    70    71    35.00000  109.50000
   74    70    72    75.00000  110.06800
   74    77    78    35.00000  109.50000
   74    77    79    35.00000  109.50000
   74    77    80    35.00000  109.50000
   74    81    82    35.00000  109.50000
   74    81    83    35.00000  109.50000
   74    81    84    35.00000  109.50000
   77    74    75    35.00000  109.50000
   79    77    78    33.00000  107.80000
   80    77    78    33.00000  107.80000
   80    77    79    33.00000  107.80000
   81    74    75    35.00000  109.50000
   81    74    77    75.00000  113.01200
   83    81    82    33.00000  107.80000
   84    81    82    33.00000  107.80000
   84    81    83    33.00000  107.80000
   54    49    52    58.35000  112.70000
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    33.00000  107.80000
   58    49    52    50.00000  109.50000
   58    49    54    50.00000  109.50000
   39    33    37    90.00000  110.39200
   39    33    38    50.00000  109.50000
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
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  105    94   -96    99   0.47100  1.0 1.0
   74    70    72    73   0.09700  1.0 1.0
   74    70    72    73   0.15600 -1.0 2.0
   74    70    72    73  -0.50800  1.0 3.0
   74    70    72    76   0.80850  1.0 1.0
   74    70    72    76  -0.47300 -1.0 2.0
   74    70    72    76  -0.52300  1.0 3.0
   75    74    77    78   0.13050  1.0 3.0
   75    74    77    79   0.13050  1.0 3.0
   75    74    77    80   0.13050  1.0 3.0
   75    74    81    82   0.13050  1.0 3.0
   75    74    81    83   0.13050  1.0 3.0
   75    74    81    84   0.13050  1.0 3.0
   77    74    81    82   0.15000  1.0 3.0
   77    74    81    83   0.15000  1.0 3.0
   77    74    81    84   0.15000  1.0 3.0
   81    74    77    78   0.15000  1.0 3.0
   81    74    77    79   0.15000  1.0 3.0
   81    74    77    80   0.15000  1.0 3.0
   54    49    52    37   0.34400  1.0 1.0
   54    49    52    37   0.09450 -1.0 2.0
   54    49    52    37   0.11100  1.0 3.0
   54    49    52    53   0.15000  1.0 3.0
   54    49    52    62   0.56750  1.0 1.0
   54    49    52    62  -0.07550 -1.0 2.0
   54    49    52    62   0.20000  1.0 3.0
   54    49    58    59  -0.11600  1.0 1.0
   54    49    58    59  -0.09450 -1.0 2.0
   54    49    58    59   0.21250  1.0 3.0
   58    49    52    37   1.05650  1.0 1.0
   58    49    52    37   0.15600 -1.0 2.0
   58    49    52    37   0.53150  1.0 3.0
   58    49    52    53   0.23400  1.0 3.0
   58    49    52    62   0.86500  1.0 1.0
   58    49    52    62  -0.17500 -1.0 2.0
   58    49    52    62   0.20800  1.0 3.0
   58    49    54    55   0.23400  1.0 3.0
   58    49    54    56   0.23400  1.0 3.0
   58    49    54    57   0.23400  1.0 3.0
   39    33    37    41   0.67800  1.0 1.0
   39    33    37    41   0.47050 -1.0 2.0
   39    33    37    41  -0.62500  1.0 3.0
   39    33    37    52   0.18000  1.0 1.0
   39    33    37    52   0.16450 -1.0 2.0
   39    33    37    52   0.04450  1.0 3.0
   39    33    38    66   0.86500  1.0 1.0
   39    33    38    66  -0.17500 -1.0 2.0
   39    33    38    66   0.20800  1.0 3.0
   39    33    38    85  -0.09450  1.0 1.0
   39    33    38    85  -1.12950 -1.0 2.0
   39    33    38    85   0.54000  1.0 3.0
   39    33    38    43   3.75450  1.0 1.0
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
   35    30    34    36  10.50000 -1.0 2.0
   33    52    37    41   1.10000 -1.0 2.0
   45    42    41    37   1.10000 -1.0 2.0
   46    65    45    41   4.00000 -1.0 2.0
   47    49    46    45   4.00000 -1.0 2.0
   50    48    47    46   1.10000 -1.0 2.0
   60    51    50    47   1.10000 -1.0 2.0
   65    61    60    50   1.10000 -1.0 2.0
   60    68    65    45   4.00000 -1.0 2.0
   70    73    72    76   1.10000 -1.0 2.0
   85    87    76    72   1.10000 -1.0 2.0
   76    38    85    86  10.50000 -1.0 2.0
   76    89    87    88  10.50000 -1.0 2.0
   90    87    89    91   1.00000 -1.0 2.0
END
