* LIGAND DATABASE FILE (OPLS2005)
*
001     118   119    224    330     660
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02042    92.73338   -64.51560
    3     1 S   H    _H1_     3     1.02056    87.73116    44.13637
    4     1 S   H    _H2_     4     1.02150    33.07494   174.53854
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04748   118.84952     8.59078
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08457   106.27517   -11.11459
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    33     1.08610   110.54789    58.81774
   26    24 S   HC   HB22    34     1.08575   109.89770   179.12800
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C10    36     1.83190    97.84684  -178.13596
   34    33 S   HC   _H3_    37     1.09849   101.80964   -32.37675
   35    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   36    35 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   37    35 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   38    33 S   CM   _C4_    38     1.52161   114.54458    79.98139
   39    38 S   HC   _H38    39     1.08841   110.65442  -151.09999
   40    33 S   CT   _C15    62     1.55764   110.89615  -145.44144
   41    40 S   HC   _H48    63     1.09993   106.77181    43.90972
   42    38 S   CMA  _C5_    40     1.35807   131.76200    25.55863
   43    42 S   OM   _O30    41     1.26365   130.51212     5.07428
   44    40 S   CT   _C26    64     1.53956   110.11397   158.18556
   45    44 S   HC   _H67    65     1.08418   109.19878    65.04508
   46    44 S   HC   _H68    66     1.08399   109.16282   -54.95960
   47    44 S   HC   _H69    67     1.08499   109.21378  -174.93593
   48    42 S   CT   _C11    42     1.56154   119.17600  -170.18654
   49    48 S   HC   _H44    43     1.10032   108.35752   144.11554
   50    48 S   CT   _C8_    44     1.55520   114.68197   -94.81271
   51    50 S   HC   _H39    45     1.09571   108.00141    52.85078
   52    50 S   HC   _H40    46     1.09818   108.06051   166.99573
   53    48 S   CT   _C22   115     1.54623   113.72557    30.67977
   54    53 S   HC   _H55   116     1.08285   108.89152   -63.20824
   55    53 S   HC   _H56   117     1.08235   108.85632   176.80776
   56    53 S   HC   _H57   118     1.08194   108.86346    56.75744
   57    50 S   CT   _C14    47     1.55169   117.11575   -71.20693
   58    57 S   HC   _H47    48     1.09528   108.89473    64.14306
   59    57 S   CT   _C17    49     1.55992   112.36734  -176.45945
   60    59 S   HC   _H50    50     1.09814   108.54091   176.28965
   61    57 S   CT   _C25   111     1.53823   111.45634   -53.82081
   62    61 S   HC   _H64   112     1.08560   109.28139   -60.95823
   63    61 S   HC   _H65   113     1.08530   109.26832   179.10649
   64    61 S   HC   _H66   114     1.08506   109.29345    59.06686
   65    59 S   CT   _C13    51     1.54131   114.99979   -62.37045
   66    65 S   HC   _H46    52     1.09494   109.60148    63.64436
   67    59 S   OS   _O38    83     1.43065   109.97171    59.55680
   68    65 S   CO4  _C6_    53     1.52451   110.80197   -57.84760
   69    68 S   O    _O33    54     1.23305   121.27811   -61.72957
   70    65 S   CT   _C24    79     1.53282   111.92310  -178.81007
   71    70 S   HC   _H61    80     1.08713   109.52600    60.39573
   72    70 S   HC   _H62    81     1.08694   109.55272   -59.58309
   73    70 S   HC   _H63    82     1.08720   109.52617  -179.63203
   74    67 S   CO   _C21    84     1.42733   111.18876   117.70106
   75    74 S   HC   _H54    85     1.09661   107.24764    60.03377
   76    68 S   CT   _C12    55     1.52097   117.15526   118.74674
   77    76 S   HC   _H45    56     1.09638   107.94423    -8.99200
   78    74 S   CT   _C18    86     1.53277   107.86963   179.58363
   79    78 S   HC   _H51    87     1.09660   109.56638    51.48959
   80    76 S   CO4  _C7_    57     1.51561   113.40354  -127.65532
   81    80 S   O    _O34    58     1.22231   125.09868   -27.62516
   82    76 S   CT   _C23    75     1.52349   109.27738   109.58423
   83    82 S   HC   _H58    76     1.08965   110.00091    62.23205
   84    82 S   HC   _H59    77     1.09008   110.01426   -57.81872
   85    82 S   HC   _H60    78     1.09053   109.99248  -177.84296
   86    78 S   CT   _C16    88     1.53502   110.87874   173.92911
   87    86 S   HC   _H49    89     1.09379   109.41871    70.41451
   88    78 S   OH   _O37   109     1.42700   107.92039   -65.65530
   89    88 S   HO   _H84   110     0.96874   106.46051   -61.05290
   90    80 S   OS   _O35    59     1.36279   108.71686   153.79229
   91    86 S   CT   _C9_    90     1.52994   110.47984   -50.04539
   92    91 S   HC   _H41    91     1.09735   110.43114   174.23540
   93    91 S   HC   _H42    92     1.09925   109.24484   -67.92165
   94    86 S   NTH0 _N29   100     1.46424   110.78161  -171.62438
   95    90 S   CT   _C20    60     1.44206   118.47171   174.05331
   96    95 S   HC   _H53    61     1.09583   110.06630    34.22804
   97    91 S   CT   _C19    93     1.52911   110.25387    52.10049
   98    97 S   HC   _H52    94     1.09716   110.53564    62.42003
   99    94 S   CT   _C29   101     1.46139   110.37016   -77.86745
  100    99 S   HC   _H76   102     1.09342   110.08547   180.00000
  101    99 S   HC   _H77   103     1.09282   110.27695    59.98971
  102    99 S   HC   _H78   104     1.09340   110.27837   -60.07074
  103    94 S   CT   _C30   105     1.46210   110.39408   159.60802
  104   103 S   HC   _H79   106     1.09323   110.08137   180.00000
  105   103 S   HC   _H80   107     1.09356   110.20215    59.98926
  106   103 S   HC   _H81   108     1.09347   110.21829   -59.98743
  107    95 S   CT   _C31    68     1.52992   107.81314   -83.77635
  108   107 S   HC   _H82    69     1.09250   108.90497   -59.61023
  109   107 S   HC   _H83    70     1.09161   108.95656    57.79431
  110    74 S   OS   _O36    95     1.42610   109.68463   -59.65365
  111    97 S   CT   _C27    96     1.52230   111.08747  -176.84433
  112   111 S   HC   _H70    97     1.09044   110.11671    58.15884
  113   111 S   HC   _H71    98     1.09100   110.05796   -61.85496
  114   111 S   HC   _H72    99     1.09063   110.02206   178.17758
  115   107 S   CT   _C28    71     1.49242   111.55619   179.11973
  116   115 S   HC   _H73    72     1.09668   109.49997   -59.19114
  117   115 S   HC   _H74    73     1.09561   110.97564  -178.34602
  118   115 S   HC   _H75    74     1.09506   110.98213    60.05062
  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   9   5   4   3
  16   7   2   1   1  11   4  14   8  11   4   7   3   2   1  12
   8  16   6   5   4   2   1   1  13   8  19   7   5   2   1   1
  13   8  10  14   5   4   2   1   1  13   6   9   7  13   7   9
   3   4   2   1   1  19   8   4   1   6  12   6   5   9   8   4
   6   5   7   3   2   1   3   2   1   1   6   5   4   4   3   2
   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    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    95    40    41    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    43    48    90    95    96    40    41    44    45    46    47   107  
   38    39    42    95    40    41    44  
   36    37  
   37  
    0  
   39    42    43    48    49    50    95    40    41    44    53  
   42    43    48    40  
   41    44    45    46    47   107   108   109   115    42    80    90    95    96  
   44    45    46    47   107    90    95    96  
   43    48    49    50    51    52    57    53    54    55    56  
   48    49    50    53  
   45    46    47   107    90    95    96  
   46    47    95  
   47    95  
   95  
   49    50    51    52    57    58    59    61    53    54    55    56  
   50    51    52    57    53    54    55    56  
   51    52    57    58    59    60    65    67    61    62    63    64    53    54    55    56  
   52    57    58    59    61    53  
   57    58    59    61    53  
   54    55    56    57  
   55    56  
   56  
    0  
   58    59    60    65    66    68    70    67    74    61    62    63    64  
   59    60    65    67    61    62    63    64  
   60    65    66    68    69    76    70    71    72    73    67    74    75    78   110    61    62    63    64  
   65    66    68    70    67    74    61  
   62    63    64    65    67  
   63    64  
   64  
    0  
   66    68    69    76    77    80    82    70    71    72    73    67    74  
   68    69    76    70    71    72    73    67  
   74    75    78    79    86    97   110    88    68    70  
   69    76    77    80    81    90    82    83    84    85    70    71    72    73  
   76    77    80    82    70  
   71    72    73    76  
   72    73  
   73  
    0  
   75    78    79    86    87    91    97    98   110   111    94    88    89  
   78    79    86    97   110    88  
   77    80    81    90    95    82    83    84    85  
   80    81    90    82    83    84    85  
   79    86    87    91    92    93    97   110    94    99   103    88    89  
   86    87    91   110    94    88    89  
   81    90    95    96   107    82    83    84    85  
   90    95    82  
   83    84    85    90  
   84    85  
   85  
    0  
   87    91    92    93    97    98   110   111    94    99   100   101   102   103   104   105   106    88    89  
   91    92    93    97    94    99   103    88  
   89    91    94   110  
    0  
   95    96   107   108   109   115  
   92    93    97    98   110   111   112   113   114    94    99   103  
   93    97    98   110   111    94  
   97    98   110   111    94  
   99   100   101   102   103   104   105   106    97  
   96   107   108   109   115   116   117   118  
  107   108   109   115  
   98   110   111   112   113   114  
  110   111   112   113   114  
  100   101   102   103   104   105   106  
  101   102   103  
  102   103  
  103  
  104   105   106  
  105   106  
  106  
    0  
  108   109   115   116   117   118  
  109   115   116   117   118  
  115   116   117   118  
  111   112   113   114  
  112   113   114  
  113   114  
  114  
    0  
  116   117   118  
  117   118  
  118  
    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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.773900   1.7825   1.5750   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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   68   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   69   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   70   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   75   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   76   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   77   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   78   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   81   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   82   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   89   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   90   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   91   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   95   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   97   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   98   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   99   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
  100   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  101   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
  104   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  108   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
  111   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  112   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  113   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  114   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  115   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  116   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  117   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  118   2.5000   0.0300   0.060000   1.4250   1.2500   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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    40   268.000  1.529
   38    39   340.000  1.080
   38    42   465.000  1.376
   42    43   745.000  1.250
   42    48   270.000  1.512
   48    49   340.000  1.090
   48    50   268.000  1.529
   48    53   268.000  1.529
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    57   268.000  1.529
   57    58   340.000  1.090
   57    59   268.000  1.529
   57    61   268.000  1.529
   59    60   340.000  1.090
   59    65   268.000  1.529
   59    67   320.000  1.410
   65    66   340.000  1.090
   65    68   317.000  1.522
   65    70   268.000  1.529
   68    69   570.000  1.229
   68    76   317.000  1.522
   76    77   340.000  1.090
   76    80   317.000  1.522
   76    82   268.000  1.529
   80    81   570.000  1.229
   80    90   214.000  1.327
   90    95   320.000  1.410
   95    96   340.000  1.090
   95    40   268.000  1.529
   95   107   268.000  1.529
   40    41   340.000  1.090
   40    44   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   340.000  1.090
  107   108   340.000  1.090
  107   109   340.000  1.090
  107   115   268.000  1.529
  115   116   340.000  1.090
  115   117   340.000  1.090
  115   118   340.000  1.090
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    85   340.000  1.090
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   340.000  1.090
   67    74   320.000  1.380
   74    75   340.000  1.090
   74    78   250.000  1.527
   74   110   320.000  1.380
   78    79   340.000  1.090
   78    86   268.000  1.529
   78    88   320.000  1.410
   86    87   340.000  1.090
   86    91   268.000  1.529
   86    94   310.000  1.447
   91    92   340.000  1.090
   91    93   340.000  1.090
   91    97   268.000  1.529
   97    98   340.000  1.090
   97   110   320.000  1.410
   97   111   268.000  1.529
  111   112   340.000  1.090
  111   113   340.000  1.090
  111   114   340.000  1.090
   94    99   310.000  1.447
   94   103   310.000  1.447
   99   100   340.000  1.090
   99   101   340.000  1.090
   99   102   340.000  1.090
  103   104   340.000  1.090
  103   105   340.000  1.090
  103   106   340.000  1.090
   88    89   553.000  0.945
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    40    75.00000  111.63000
   33    38    39    35.00000  117.00000
   33    38    42    70.00000  124.00000
   33    40    95    58.35000  112.70000
   33    40    41    37.50000  110.70000
   33    40    44    58.35000  112.70000
   38    33    34    35.00000  109.50000
   38    42    43    65.00000  137.10300
   38    42    48    65.00000  122.18000
   42    38    39    40.00000  120.50800
   42    48    49    45.00000  110.52000
   42    48    50    70.00000  112.02700
   42    48    53    70.00000  112.02700
   48    42    43    85.00000  112.85300
   48    50    51    37.50000  110.70000
   48    50    52    37.50000  110.70000
   48    50    57    58.35000  112.70000
   48    53    54    37.50000  110.70000
   48    53    55    37.50000  110.70000
   48    53    56    37.50000  110.70000
   50    48    49    37.50000  110.70000
   50    57    58    37.50000  110.70000
   50    57    59    58.35000  112.70000
   50    57    61    58.35000  112.70000
   52    50    51    33.00000  107.80000
   57    50    51    37.50000  110.70000
   57    50    52    37.50000  110.70000
   57    59    60    37.50000  110.70000
   57    59    65    58.35000  112.70000
   57    59    67    50.00000  109.50000
   57    61    62    37.50000  110.70000
   57    61    63    37.50000  110.70000
   57    61    64    37.50000  110.70000
   59    57    58    37.50000  110.70000
   59    65    66    37.50000  110.70000
   59    65    68    63.00000  111.10000
   59    65    70    58.35000  112.70000
   59    67    74    60.00000  109.50000
   65    59    60    37.50000  110.70000
   65    68    69    80.00000  120.40000
   65    68    76    70.00000  116.00000
   65    70    71    37.50000  110.70000
   65    70    72    37.50000  110.70000
   65    70    73    37.50000  110.70000
   68    65    66    35.00000  109.50000
   68    76    77    35.00000  109.50000
   68    76    80    75.00000  107.99600
   68    76    82    63.00000  111.10000
   76    68    69    80.00000  120.40000
   76    80    81    80.00000  120.40000
   76    80    90    81.00000  111.40000
   76    82    83    37.50000  110.70000
   76    82    84    37.50000  110.70000
   76    82    85    37.50000  110.70000
   80    76    77    35.00000  109.50000
   80    90    95    83.00000  116.90000
   90    80    81    83.00000  123.40000
   90    95    96    35.00000  109.50000
   90    95    40    50.00000  109.50000
   90    95   107    50.00000  109.50000
   95    40    41    37.50000  110.70000
   95    40    44    58.35000  112.70000
   95   107   108    37.50000  110.70000
   95   107   109    37.50000  110.70000
   95   107   115    58.35000  112.70000
   40    33    34    37.50000  110.70000
   40    33    38    70.00000  112.02700
   40    95    96    37.50000  110.70000
   40    44    45    37.50000  110.70000
   40    44    46    37.50000  110.70000
   40    44    47    37.50000  110.70000
   44    40    41    37.50000  110.70000
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    33.00000  107.80000
  107    95    96    37.50000  110.70000
  107    95    40    58.35000  112.70000
  107   115   116    37.50000  110.70000
  107   115   117    37.50000  110.70000
  107   115   118    37.50000  110.70000
  109   107   108    33.00000  107.80000
  115   107   108    37.50000  110.70000
  115   107   109    37.50000  110.70000
  117   115   116    33.00000  107.80000
  118   115   116    33.00000  107.80000
  118   115   117    33.00000  107.80000
   82    76    77    37.50000  110.70000
   82    76    80    63.00000  111.10000
   84    82    83    33.00000  107.80000
   85    82    83    33.00000  107.80000
   85    82    84    33.00000  107.80000
   70    65    66    37.50000  110.70000
   70    65    68    63.00000  111.10000
   72    70    71    33.00000  107.80000
   73    70    71    33.00000  107.80000
   73    70    72    33.00000  107.80000
   67    59    60    35.00000  109.50000
   67    59    65    50.00000  109.50000
   67    74    75    35.00000  109.50000
   67    74    78    90.00000  108.56700
   67    74   110    92.60000  111.55000
   74    78    79    45.00000  108.72000
   74    78    86    75.00000  109.43000
   74    78    88    90.00000  111.58700
   74   110    97    60.00000  109.50000
   78    74    75    45.00000  112.01100
   78    86    87    37.50000  110.70000
   78    86    91    58.35000  112.70000
   78    86    94    75.00000  113.73300
   78    88    89    55.00000  108.50000
   86    78    79    37.50000  110.70000
   86    91    92    37.50000  110.70000
   86    91    93    37.50000  110.70000
   86    91    97    58.35000  112.70000
   86    94    99    80.00000  110.40700
   86    94   103    80.00000  110.40700
   91    86    87    37.50000  110.70000
   91    97    98    37.50000  110.70000
   91    97   110    50.00000  109.50000
   91    97   111    58.35000  112.70000
   93    91    92    33.00000  107.80000
   97    91    92    37.50000  110.70000
   97    91    93    37.50000  110.70000
   97   111   112    37.50000  110.70000
   97   111   113    37.50000  110.70000
   97   111   114    37.50000  110.70000
  110    74    75    35.00000  109.50000
  110    74    78    90.00000  108.56700
  110    97    98    35.00000  109.50000
  111    97    98    37.50000  110.70000
  111    97   110    50.00000  109.50000
  113   111   112    33.00000  107.80000
  114   111   112    33.00000  107.80000
  114   111   113    33.00000  107.80000
   94    86    87    50.00000  110.15500
   94    86    91    75.00000  113.73300
   94    99   100    50.00000  110.15500
   94    99   101    50.00000  110.15500
   94    99   102    50.00000  110.15500
   94   103   104    50.00000  110.15500
   94   103   105    50.00000  110.15500
   94   103   106    50.00000  110.15500
  101    99   100    33.00000  107.80000
  102    99   100    33.00000  107.80000
  102    99   101    33.00000  107.80000
  103    94    99    80.00000  110.40700
  105   103   104    33.00000  107.80000
  106   103   104    33.00000  107.80000
  106   103   105    33.00000  107.80000
   88    78    79    35.00000  109.50000
   88    78    86    50.00000  109.50000
   61    57    58    37.50000  110.70000
   61    57    59    58.35000  112.70000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
   53    48    49    37.50000  110.70000
   53    48    50    58.35000  112.70000
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
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   79    78    86    94   0.15000  1.0 3.0
   79    78    88    89   0.19450  1.0 3.0
   86    78    88    89  -0.11600  1.0 1.0
   86    78    88    89  -0.09450 -1.0 2.0
   86    78    88    89   0.21250  1.0 3.0
   86    91    97    98   0.15000  1.0 3.0
   86    91    97   110   0.62750  1.0 1.0
   86    91    97   110  -0.30950 -1.0 2.0
   86    91    97   110   0.27300  1.0 3.0
   86    91    97   111   0.56750  1.0 1.0
   86    91    97   111  -0.07550 -1.0 2.0
   86    91    97   111   0.20000  1.0 3.0
   86    94    99   100   0.28000  1.0 3.0
   86    94    99   101   0.28000  1.0 3.0
   86    94    99   102   0.28000  1.0 3.0
   86    94   103   104   0.28000  1.0 3.0
   86    94   103   105   0.28000  1.0 3.0
   86    94   103   106   0.28000  1.0 3.0
   87    86    91    92   0.15000  1.0 3.0
   87    86    91    93   0.15000  1.0 3.0
   87    86    91    97   0.15000  1.0 3.0
   87    86    94    99   0.28000  1.0 3.0
   87    86    94   103   0.28000  1.0 3.0
   91    86    94    99   1.99000  1.0 1.0
   91    86    94    99   0.18800 -1.0 2.0
   91    86    94    99   0.81350  1.0 3.0
   91    86    94   103   1.99000  1.0 1.0
   91    86    94   103   0.18800 -1.0 2.0
   91    86    94   103   0.81350  1.0 3.0
   91    97  -110    74   0.06250  1.0 1.0
   91    97  -110    74  -0.01100 -1.0 2.0
   91    97  -110    74   0.28050  1.0 3.0
   91    97   111   112   0.15000  1.0 3.0
   91    97   111   113   0.15000  1.0 3.0
   91    97   111   114   0.15000  1.0 3.0
   92    91    97    98   0.15000  1.0 3.0
   92    91    97   110   0.23400  1.0 3.0
   92    91    97   111   0.15000  1.0 3.0
   93    91    97    98   0.15000  1.0 3.0
   93    91    97   110   0.23400  1.0 3.0
   93    91    97   111   0.15000  1.0 3.0
   98    97   110    74   0.37050  1.0 3.0
   98    97   111   112   0.15000  1.0 3.0
   98    97   111   113   0.15000  1.0 3.0
   98    97   111   114   0.15000  1.0 3.0
  110    74    78    79   0.23400  1.0 3.0
  110    74   -78    86   0.62750  1.0 1.0
  110    74   -78    86  -0.30950 -1.0 2.0
  110    74   -78    86   0.27300  1.0 3.0
  110    74    78    88   3.69350  1.0 1.0
  110    74    78    88  -1.82950 -1.0 2.0
  110    97   111   112   0.23400  1.0 3.0
  110    97   111   113   0.23400  1.0 3.0
  110    97   111   114   0.23400  1.0 3.0
  111    97   110    74   0.06250  1.0 1.0
  111    97   110    74  -0.01100 -1.0 2.0
  111    97   110    74   0.28050  1.0 3.0
   94    86    91    92   0.15000  1.0 3.0
   94    86    91    93   0.15000  1.0 3.0
   94    86    91    97   1.85550  1.0 1.0
   94    86    91    97  -0.84100 -1.0 2.0
   99    94   103   104   0.28000  1.0 3.0
   99    94   103   105   0.28000  1.0 3.0
   99    94   103   106   0.28000  1.0 3.0
  103    94    99   100   0.28000  1.0 3.0
  103    94    99   101   0.28000  1.0 3.0
  103    94    99   102   0.28000  1.0 3.0
   88    78    86    87   0.23400  1.0 3.0
   88    78    86    91   0.86500  1.0 1.0
   88    78    86    91  -0.17500 -1.0 2.0
   88    78    86    91   0.20800  1.0 3.0
   88    78    86    94   3.18500  1.0 1.0
   61    57    59    60   0.15000  1.0 3.0
   61    57    59    65   0.56750  1.0 1.0
   61    57    59    65  -0.07550 -1.0 2.0
   61    57    59    65   0.20000  1.0 3.0
   61    57    59    67   0.62750  1.0 1.0
   61    57    59    67  -0.30950 -1.0 2.0
   61    57    59    67   0.27300  1.0 3.0
   53    48    50    51   0.15000  1.0 3.0
   53    48    50    52   0.15000  1.0 3.0
   53    48    50    57   0.56750  1.0 1.0
   53    48    50    57  -0.07550 -1.0 2.0
   53    48    50    57   0.20000  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
   37    30    35    36  10.50000 -1.0 2.0
   33    39    38    42   1.10000 -1.0 2.0
   48    43    42    38   1.10000 -1.0 2.0
   65    76    68    69  10.50000 -1.0 2.0
   76    90    80    81  10.50000 -1.0 2.0
END
