* LIGAND DATABASE FILE (OPLS2005)
*
001     118   119    221    327     651
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02053    98.40991    24.30650
    3     1 S   H    _H1_     3     1.02135    35.92248   134.64305
    4     1 S   H    _H2_     4     1.02067    80.34946   -83.33724
    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     1.08641   109.88695   179.08657
   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   _C13    36     1.82739    97.96334   -78.15255
   34    33 S   HC   _H3_    37     1.09590   106.26095    38.95070
   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   _C6_    38     1.50717   108.96276   -80.01201
   39    38 S   HC   _H40    39     1.08763   116.83659   -69.18584
   40    33 S   CM   _C8_    66     1.50973   109.17424   158.59157
   41    40 S   HC   _H42    67     1.09088   115.38737    53.20163
   42    38 S   CM   _C7_    40     1.34334   123.30319   111.49580
   43    42 S   HC   _H41    41     1.08907   117.27980    -1.80743
   44    42 S   CT   _C15    42     1.51890   127.69936   179.96044
   45    44 S   HC   _H49    43     1.09926   105.91386   121.12108
   46    44 S   CT   _C22    44     1.55307   112.74081  -122.04004
   47    46 S   HC   _H56    45     1.09883   107.83914  -177.31183
   48    44 S   CT   _C25   115     1.53648   114.28193     4.24874
   49    48 S   HC   _H61   116     1.08551   109.36007   -63.47139
   50    48 S   HC   _H62   117     1.08562   109.37858   176.51019
   51    48 S   HC   _H63   118     1.08615   109.33578    56.50806
   52    46 S   OS   _O35    46     1.44635   108.83967    64.79019
   53    46 S   CT   _C32   108     1.52925   113.27958   -57.27548
   54    53 S   HC   _H82   109     1.09281   108.92906    61.62664
   55    53 S   HC   _H83   110     1.09190   109.02541   179.03409
   56    52 S   CO4  _C10    47     1.35788   118.01570   157.66266
   57    56 S   O    _O34    48     1.22331   126.90104    -0.57878
   58    53 S   CT   _C29   111     1.49289   111.60597   -59.58943
   59    58 S   HC   _H73   112     1.09646   109.47580   -59.19745
   60    58 S   HC   _H74   113     1.09544   110.96475  -178.35741
   61    58 S   HC   _H75   114     1.09527   110.95153    60.01995
   62    56 S   CM   _C4_    49     1.47786   110.95921   176.37372
   63    62 S   HC   _H38    50     1.08555   116.17411  -153.99702
   64    62 S   CM   _C5_    51     1.33989   122.71438    27.16129
   65    64 S   HC   _H39    52     1.08636   119.82191     1.69685
   66    64 S   CT   _C14    53     1.51338   123.53727  -178.01397
   67    66 S   HC   _H48    54     1.09963   107.73958    -1.96782
   68    66 S   CT   _C19    55     1.55619   112.49267   114.73254
   69    68 S   HC   _H53    56     1.09823   108.60658   169.39264
   70    66 S   CT   _C24   104     1.53025   110.69904  -116.82904
   71    70 S   HC   _H58   105     1.08665   109.68775   -63.78114
   72    70 S   HC   _H59   106     1.08880   109.60079   176.25247
   73    70 S   HC   _H60   107     1.08761   109.66184    56.35235
   74    68 S   CT   _C17    57     1.55838   118.54323    44.63574
   75    74 S   HC   _H51    58     1.09554   107.59393   -59.65769
   76    68 S   OS   _O38    76     1.43869   106.54884   -76.29550
   77    74 S   CT   _C11    59     1.55831   110.46309  -176.17561
   78    77 S   HC   _H43    60     1.09606   109.99313    46.88795
   79    77 S   HC   _H44    61     1.09783   108.63039   -68.59275
   80    74 S   CT   _C27    72     1.53134   112.41889    59.92253
   81    80 S   HC   _H67    73     1.08715   109.71407    61.05345
   82    80 S   HC   _H68    74     1.08790   109.65389   -58.95985
   83    80 S   HC   _H69    75     1.08821   109.66057  -178.93725
   84    76 S   CO   _C23    77     1.42678   110.88090   -85.77854
   85    84 S   HC   _H57    78     1.09581   107.17325    30.03257
   86    77 S   CT   _C16    62     1.55692   115.49289   168.76117
   87    86 S   HC   _H50    63     1.09864   106.82589    65.24380
   88    84 S   CT   _C20    79     1.53317   107.90884   149.60151
   89    88 S   HC   _H54    80     1.09734   109.50392    51.43728
   90    86 S   CMA  _C9_    64     1.55002   113.85786   -54.46909
   91    90 S   OM   _O33    65     1.26353   112.89526   -69.20901
   92    86 S   CT   _C26    68     1.54158   109.99680   177.36961
   93    92 S   HC   _H64    69     1.08405   109.07368    65.98422
   94    92 S   HC   _H65    70     1.08392   109.09655   -54.02488
   95    92 S   HC   _H66    71     1.08417   109.10696  -174.01994
   96    88 S   CT   _C18    81     1.53460   110.95819   173.94702
   97    96 S   HC   _H52    82     1.09455   109.38331    70.32083
   98    88 S   OH   _O37   102     1.42673   107.88395   -65.60956
   99    98 S   HO   _H84   103     0.96933   106.48119   -61.11340
  100    96 S   CT   _C12    83     1.53078   110.41013   -50.02885
  101   100 S   HC   _H45    84     1.09713   110.38155   174.21426
  102   100 S   HC   _H46    85     1.09925   109.27277   -68.00903
  103    96 S   NTH0 _N30    93     1.46319   110.82524  -171.59417
  104   100 S   CT   _C21    86     1.52839   110.29259    52.05923
  105   104 S   HC   _H55    87     1.09823   110.53972    62.40256
  106   103 S   CT   _C30    94     1.46225   110.33403   -77.90278
  107   106 S   HC   _H76    95     1.09403   110.05662  -179.97202
  108   106 S   HC   _H77    96     1.09315   110.26093    60.02845
  109   106 S   HC   _H78    97     1.09346   110.24001   -60.01893
  110   103 S   CT   _C31    98     1.46124   110.40399   159.61072
  111   110 S   HC   _H79    99     1.09310   110.12853  -179.97202
  112   110 S   HC   _H80   100     1.09363   110.24324    59.92726
  113   110 S   HC   _H81   101     1.09307   110.22473   -60.01321
  114    84 S   OS   _O36    88     1.42599   109.71251   -89.64805
  115   104 S   CT   _C28    89     1.52264   111.13525  -176.91067
  116   115 S   HC   _H70    90     1.09057   110.03692    58.19929
  117   115 S   HC   _H71    91     1.09050   110.05759   -61.76917
  118   115 S   HC   _H72    92     1.09048   110.05823   178.18469
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   8   5   4   3
  11   6   2   1   1  10   4   8   3  11   4  13   8  16   7   5
   2   1   1   9   7   5   4   6   3   3   2   1   1   7   3  11
   4  13   8  20   7   5   2   1   1  14   9  10  14   6   5   4
   2   1   1  13   6   7   6  13   7   5   1   3   2   1   1  19
   8   4   1  12   6   5   9   6   5   7   3   2   1   3   2   1
   1   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    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    90    40    41  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    43    44    86    90    91    40    41  
   38    39    42    90    40    41  
   36    37  
   37  
    0  
   39    42    43    44    45    46    90    40    41    48  
   42    43    44    40  
   41    92    42    77    86    87    90    91  
   86    90    91  
   43    44    45    46    47    52    53    48    49    50    51  
   44    45    46    48  
   45    46    47    52    56    53    54    55    58    48    49    50    51  
   46    47    52    53    48    49    50    51  
   47    52    56    57    62    53    54    55    58    59    60    61    48    49    50    51  
   52    56    53    54    55    58    48  
   49    50    51    52    53  
   50    51  
   51  
    0  
   56    57    62    63    64    53    54    55    58  
   54    55    58    59    60    61    56  
   55    58    59    60    61  
   58    59    60    61  
   57    62    63    64    65    66  
   62    63    64  
   59    60    61  
   60    61  
   61  
    0  
   63    64    65    66    67    68    70  
   64    65    66  
   65    66    67    68    69    74    76    70    71    72    73  
   66    67    68    70  
   67    68    69    74    75    77    80    76    84    70    71    72    73  
   68    69    74    76    70    71    72    73  
   69    74    75    77    78    79    86    80    81    82    83    76    84    85    88   114    70    71    72    73  
   74    75    77    80    76    84    70  
   71    72    73    74    76  
   72    73  
   73  
    0  
   75    77    78    79    86    87    90    92    80    81    82    83    76    84  
   77    78    79    86    80    81    82    83    76  
   84    85    88    89    96   104   114    98    77    80  
   78    79    86    87    90    91    92    93    94    95    80    81    82    83  
   79    86    87    90    92    80  
   86    87    90    92    80  
   81    82    83    86  
   82    83  
   83  
    0  
   85    88    89    96    97   100   104   105   114   115   103    98    99  
   88    89    96   104   114    98  
   87    90    91    92    93    94    95  
   90    91    92    93    94    95  
   89    96    97   100   101   102   104   114   103   106   110    98    99  
   96    97   100   114   103    98    99  
   91    92    93    94    95  
   92  
   93    94    95  
   94    95  
   95  
    0  
   97   100   101   102   104   105   114   115   103   106   107   108   109   110   111   112   113    98    99  
  100   101   102   104   103   106   110    98  
   99   100   103   114  
    0  
  101   102   104   105   114   115   116   117   118   103   106   110  
  102   104   105   114   115   103  
  104   105   114   115   103  
  106   107   108   109   110   111   112   113   104  
  105   114   115   116   117   118  
  114   115   116   117   118  
  107   108   109   110   111   112   113  
  108   109   110  
  109   110  
  110  
  111   112   113  
  112   113  
  113  
    0  
  115   116   117   118  
  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  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   41   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   43   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   48   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   53   3.5000   0.0660  -0.120000   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   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   58   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   63   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   65   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   77   3.5000   0.0660  -0.120000   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   91   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   92   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   99   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  100   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
  104   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
  105   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  106   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
  107   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
  111   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  112   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  113   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  114   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
  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   317.000  1.510
   38    39   340.000  1.080
   38    42   549.000  1.340
   42    43   340.000  1.080
   42    44   317.000  1.510
   44    45   340.000  1.090
   44    46   268.000  1.529
   44    48   268.000  1.529
   46    47   340.000  1.090
   46    52   320.000  1.410
   46    53   268.000  1.529
   52    56   214.000  1.327
   56    57   570.000  1.229
   56    62   320.000  1.462
   62    63   340.000  1.080
   62    64   549.000  1.340
   64    65   340.000  1.080
   64    66   317.000  1.510
   66    67   340.000  1.090
   66    68   268.000  1.529
   66    70   268.000  1.529
   68    69   340.000  1.090
   68    74   268.000  1.529
   68    76   320.000  1.410
   74    75   340.000  1.090
   74    77   268.000  1.529
   74    80   268.000  1.529
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    86   268.000  1.529
   86    87   340.000  1.090
   86    90   270.000  1.512
   86    92   268.000  1.529
   90    91   745.000  1.250
   90    40   465.000  1.376
   40    41   340.000  1.080
   92    93   340.000  1.090
   92    94   340.000  1.090
   92    95   340.000  1.090
   80    81   340.000  1.090
   80    82   340.000  1.090
   80    83   340.000  1.090
   76    84   320.000  1.380
   84    85   340.000  1.090
   84    88   250.000  1.527
   84   114   320.000  1.380
   88    89   340.000  1.090
   88    96   268.000  1.529
   88    98   320.000  1.410
   96    97   340.000  1.090
   96   100   268.000  1.529
   96   103   310.000  1.447
  100   101   340.000  1.090
  100   102   340.000  1.090
  100   104   268.000  1.529
  104   105   340.000  1.090
  104   114   320.000  1.410
  104   115   268.000  1.529
  115   116   340.000  1.090
  115   117   340.000  1.090
  115   118   340.000  1.090
  103   106   310.000  1.447
  103   110   310.000  1.447
  106   107   340.000  1.090
  106   108   340.000  1.090
  106   109   340.000  1.090
  110   111   340.000  1.090
  110   112   340.000  1.090
  110   113   340.000  1.090
   98    99   553.000  0.945
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   340.000  1.090
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    58   268.000  1.529
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   340.000  1.090
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   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  112.20000
   33    38    39    35.00000  117.00000
   33    38    42    70.00000  124.00000
   33    40    90    70.00000  124.00000
   33    40    41    35.00000  117.00000
   38    33    34    35.00000  109.50000
   38    42    43    35.00000  120.00000
   38    42    44    70.00000  124.00000
   42    38    39    35.00000  120.00000
   42    44    45    35.00000  109.50000
   42    44    46    70.00000  112.02700
   42    44    48    70.00000  112.02700
   44    42    43    35.00000  117.00000
   44    46    47    37.50000  110.70000
   44    46    52    50.00000  109.50000
   44    46    53    58.35000  112.70000
   44    48    49    37.50000  110.70000
   44    48    50    37.50000  110.70000
   44    48    51    37.50000  110.70000
   46    44    45    37.50000  110.70000
   46    52    56    83.00000  116.90000
   46    53    54    37.50000  110.70000
   46    53    55    37.50000  110.70000
   46    53    58    58.35000  112.70000
   52    46    47    35.00000  109.50000
   52    56    57    83.00000  123.40000
   52    56    62    90.00000  111.29400
   56    62    63    40.00000  117.72500
   56    62    64    65.00000  118.96000
   62    56    57    80.00000  123.72100
   62    64    65    35.00000  120.00000
   62    64    66    70.00000  124.00000
   64    62    63    35.00000  120.00000
   64    66    67    35.00000  109.50000
   64    66    68    70.00000  112.02700
   64    66    70    70.00000  112.02700
   66    64    65    35.00000  117.00000
   66    68    69    37.50000  110.70000
   66    68    74    58.35000  112.70000
   66    68    76    50.00000  109.50000
   66    70    71    37.50000  110.70000
   66    70    72    37.50000  110.70000
   66    70    73    37.50000  110.70000
   68    66    67    37.50000  110.70000
   68    74    75    37.50000  110.70000
   68    74    77    58.35000  112.70000
   68    74    80    58.35000  112.70000
   68    76    84    60.00000  109.50000
   74    68    69    37.50000  110.70000
   74    77    78    37.50000  110.70000
   74    77    79    37.50000  110.70000
   74    77    86    58.35000  112.70000
   74    80    81    37.50000  110.70000
   74    80    82    37.50000  110.70000
   74    80    83    37.50000  110.70000
   77    74    75    37.50000  110.70000
   77    86    87    37.50000  110.70000
   77    86    90    70.00000  112.02700
   77    86    92    58.35000  112.70000
   79    77    78    33.00000  107.80000
   86    77    78    37.50000  110.70000
   86    77    79    37.50000  110.70000
   86    90    91    85.00000  112.85300
   86    90    40    65.00000  122.18000
   86    92    93    37.50000  110.70000
   86    92    94    37.50000  110.70000
   86    92    95    37.50000  110.70000
   90    86    87    45.00000  110.52000
   90    40    41    40.00000  120.50800
   40    33    34    35.00000  109.50000
   40    33    38    70.00000  110.12100
   40    90    91    65.00000  137.10300
   92    86    87    37.50000  110.70000
   92    86    90    70.00000  112.02700
   94    92    93    33.00000  107.80000
   95    92    93    33.00000  107.80000
   95    92    94    33.00000  107.80000
   80    74    75    37.50000  110.70000
   80    74    77    58.35000  112.70000
   82    80    81    33.00000  107.80000
   83    80    81    33.00000  107.80000
   83    80    82    33.00000  107.80000
   76    68    69    35.00000  109.50000
   76    68    74    50.00000  109.50000
   76    84    85    35.00000  109.50000
   76    84    88    90.00000  108.56700
   76    84   114    92.60000  111.55000
   84    88    89    45.00000  108.72000
   84    88    96    75.00000  109.43000
   84    88    98    90.00000  111.58700
   84   114   104    60.00000  109.50000
   88    84    85    45.00000  112.01100
   88    96    97    37.50000  110.70000
   88    96   100    58.35000  112.70000
   88    96   103    75.00000  113.73300
   88    98    99    55.00000  108.50000
   96    88    89    37.50000  110.70000
   96   100   101    37.50000  110.70000
   96   100   102    37.50000  110.70000
   96   100   104    58.35000  112.70000
   96   103   106    80.00000  110.40700
   96   103   110    80.00000  110.40700
  100    96    97    37.50000  110.70000
  100   104   105    37.50000  110.70000
  100   104   114    50.00000  109.50000
  100   104   115    58.35000  112.70000
  102   100   101    33.00000  107.80000
  104   100   101    37.50000  110.70000
  104   100   102    37.50000  110.70000
  104   115   116    37.50000  110.70000
  104   115   117    37.50000  110.70000
  104   115   118    37.50000  110.70000
  114    84    85    35.00000  109.50000
  114    84    88    90.00000  108.56700
  114   104   105    35.00000  109.50000
  115   104   105    37.50000  110.70000
  115   104   114    50.00000  109.50000
  117   115   116    33.00000  107.80000
  118   115   116    33.00000  107.80000
  118   115   117    33.00000  107.80000
  103    96    97    50.00000  110.15500
  103    96   100    75.00000  113.73300
  103   106   107    50.00000  110.15500
  103   106   108    50.00000  110.15500
  103   106   109    50.00000  110.15500
  103   110   111    50.00000  110.15500
  103   110   112    50.00000  110.15500
  103   110   113    50.00000  110.15500
  108   106   107    33.00000  107.80000
  109   106   107    33.00000  107.80000
  109   106   108    33.00000  107.80000
  110   103   106    80.00000  110.40700
  112   110   111    33.00000  107.80000
  113   110   111    33.00000  107.80000
  113   110   112    33.00000  107.80000
   98    88    89    35.00000  109.50000
   98    88    96    50.00000  109.50000
   70    66    67    37.50000  110.70000
   70    66    68    58.35000  112.70000
   72    70    71    33.00000  107.80000
   73    70    71    33.00000  107.80000
   73    70    72    33.00000  107.80000
   53    46    47    37.50000  110.70000
   53    46    52    50.00000  109.50000
   53    58    59    37.50000  110.70000
   53    58    60    37.50000  110.70000
   53    58    61    37.50000  110.70000
   55    53    54    33.00000  107.80000
   58    53    54    37.50000  110.70000
   58    53    55    37.50000  110.70000
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    33.00000  107.80000
   48    44    45    37.50000  110.70000
   48    44    46    58.35000  112.70000
   50    48    49    33.00000  107.80000
   51    48    49    33.00000  107.80000
   51    48    50    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
    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
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  100    96   103   106   0.81350  1.0 3.0
  100    96   103   110   1.99000  1.0 1.0
  100    96   103   110   0.18800 -1.0 2.0
  100    96   103   110   0.81350  1.0 3.0
  100   104  -114    84   0.06250  1.0 1.0
  100   104  -114    84  -0.01100 -1.0 2.0
  100   104  -114    84   0.28050  1.0 3.0
  100   104   115   116   0.15000  1.0 3.0
  100   104   115   117   0.15000  1.0 3.0
  100   104   115   118   0.15000  1.0 3.0
  101   100   104   105   0.15000  1.0 3.0
  101   100   104   114   0.23400  1.0 3.0
  101   100   104   115   0.15000  1.0 3.0
  102   100   104   105   0.15000  1.0 3.0
  102   100   104   114   0.23400  1.0 3.0
  102   100   104   115   0.15000  1.0 3.0
  105   104   114    84   0.37050  1.0 3.0
  105   104   115   116   0.15000  1.0 3.0
  105   104   115   117   0.15000  1.0 3.0
  105   104   115   118   0.15000  1.0 3.0
  114    84    88    89   0.23400  1.0 3.0
  114    84   -88    96   0.62750  1.0 1.0
  114    84   -88    96  -0.30950 -1.0 2.0
  114    84   -88    96   0.27300  1.0 3.0
  114    84    88    98   3.69350  1.0 1.0
  114    84    88    98  -1.82950 -1.0 2.0
  114   104   115   116   0.23400  1.0 3.0
  114   104   115   117   0.23400  1.0 3.0
  114   104   115   118   0.23400  1.0 3.0
  115   104   114    84   0.06250  1.0 1.0
  115   104   114    84  -0.01100 -1.0 2.0
  115   104   114    84   0.28050  1.0 3.0
  103    96   100   101   0.15000  1.0 3.0
  103    96   100   102   0.15000  1.0 3.0
  103    96   100   104   1.85550  1.0 1.0
  103    96   100   104  -0.84100 -1.0 2.0
  106   103   110   111   0.28000  1.0 3.0
  106   103   110   112   0.28000  1.0 3.0
  106   103   110   113   0.28000  1.0 3.0
  110   103   106   107   0.28000  1.0 3.0
  110   103   106   108   0.28000  1.0 3.0
  110   103   106   109   0.28000  1.0 3.0
   98    88    96    97   0.23400  1.0 3.0
   98    88    96   100   0.86500  1.0 1.0
   98    88    96   100  -0.17500 -1.0 2.0
   98    88    96   100   0.20800  1.0 3.0
   98    88    96   103   3.18500  1.0 1.0
   70    66    68    69   0.15000  1.0 3.0
   70    66    68    74   0.56750  1.0 1.0
   70    66    68    74  -0.07550 -1.0 2.0
   70    66    68    74   0.20000  1.0 3.0
   70    66    68    76   0.62750  1.0 1.0
   70    66    68    76  -0.30950 -1.0 2.0
   70    66    68    76   0.27300  1.0 3.0
   53    46    52    56  -0.25900  1.0 1.0
   53    46    52    56  -0.47000 -1.0 2.0
   53    46    52    56   0.11750  1.0 3.0
   54    53    58    59   0.15000  1.0 3.0
   54    53    58    60   0.15000  1.0 3.0
   54    53    58    61   0.15000  1.0 3.0
   55    53    58    59   0.15000  1.0 3.0
   55    53    58    60   0.15000  1.0 3.0
   55    53    58    61   0.15000  1.0 3.0
   48    44    46    47   0.15000  1.0 3.0
   48    44    46    52   0.62750  1.0 1.0
   48    44    46    52  -0.30950 -1.0 2.0
   48    44    46    52   0.27300  1.0 3.0
   48    44    46    53   0.56750  1.0 1.0
   48    44    46    53  -0.07550 -1.0 2.0
   48    44    46    53   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
   44    43    42    38   1.10000 -1.0 2.0
   52    62    56    57  10.50000 -1.0 2.0
   56    63    62    64   1.10000 -1.0 2.0
   66    65    64    62   1.10000 -1.0 2.0
   86    91    90    40   1.10000 -1.0 2.0
   33    41    40    90   1.10000 -1.0 2.0
END
