* LIGAND DATABASE FILE (OPLS2005)
*
001     118   121    221    352     660
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02077   106.59695   -17.67449
    3     1 S   H    _H1_     3     1.02110    58.08060    84.37738
    4     1 S   H    _H2_     4     1.02098    54.04947  -119.06376
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    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     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08491   110.56590    58.74922
   26    24 S   HC   HB22    34     1.08612   109.94660   179.10082
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C25    36     1.86367    97.40736   161.83164
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CM   _C26    37     1.51220   106.12199   -79.96121
   38    33 S   OH   _O38   117     1.43541   107.04471    38.22825
   39    38 S   HO   _H28   118     0.96889   106.19567    64.73181
   40    37 S   CMA  _C28    38     1.49774   116.37274   -73.41720
   41    40 S   OM   _O37    39     1.23059   120.47331   145.10085
   42    37 S   C    _C27   112     1.34099   126.94889   107.48865
   43    42 S   O    _O36   113     1.26177   130.10015   179.14316
   44    40 S   CT   _C19    40     1.53711   117.04871   -32.23546
   45    42 S   N    _N6_   114     1.37428   120.13705    -0.89896
   46    45 S   H    _H26   115     1.01251   119.30911    -0.02798
   47    45 S   H    _H27   116     1.01199   120.27792  -179.97202
   48    44 S   CM   _C18    41     1.52244   108.66828  -143.85636
   49    44 S   CT   _C20    94     1.54655   111.89902   -19.70279
   50    49 S   HC   _H3_    95     1.10129   108.99500   170.39459
   51    44 S   OH   _O39   110     1.42635   107.46631    97.35305
   52    51 S   HO   _H36   111     0.96805   106.18402   178.09505
   53    48 S   CM   _C17    42     1.34870   122.88330   106.58930
   54    33 S   CT   _C24    96     1.55803   115.08003   156.78059
   55    54 S   HC   _H5_    97     1.10837   107.66269  -135.68877
   56    48 S   OH   _O40   108     1.38516   116.05409   -73.56416
   57    56 S   HO   _H37   109     0.96133   109.74196  -179.96044
   58    53 S   CO4  _C16    43     1.50158   120.54432   177.02099
   59    58 S   O    _O35    44     1.22604   122.88653   -15.98482
   60    54 S   NP   _N7_    98     1.49763   110.44742   -23.53908
   61    60 S   H    _H29    99     1.03121   107.13929    48.58924
   62    58 S   CA   _C14    45     1.48508   117.42120   165.18604
   63    60 S   CT   _C29   100     1.50382   112.18422   165.24282
   64    63 S   HC   _H30   101     1.09181   107.80257    63.02653
   65    63 S   HC   _H31   102     1.09203   107.85989  -176.96256
   66    63 S   HC   _H32   103     1.09222   107.83417   -56.92161
   67    60 S   CT   _C30   104     1.50427   112.21589   -67.99990
   68    67 S   HC   _H33   105     1.09226   107.76154   -63.02023
   69    67 S   HC   _H34   106     1.09145   107.86889    56.94133
   70    67 S   HC   _H35   107     1.09175   107.84017   177.01417
   71    62 S   CA   _C13    46     1.40163   120.81424    -7.82594
   72    71 S   CA   _C12    47     1.40138   119.23173  -178.17351
   73    71 S   CT   _C23    86     1.50338   120.92912    -0.78185
   74    73 S   HC   _H24    87     1.09898   110.42485   151.43822
   75    73 S   HC   _H25    88     1.09585   108.09044   -91.47249
   76    72 S   CA   _C11    48     1.39453   120.58214    -1.18564
   77    76 S   HA   _H20    49     1.08794   120.04853  -179.66023
   78    72 S   NE   _N8_    77     1.41570   121.36198   178.31391
   79    53 S   CT   _C22    89     1.50866   123.07560    -1.29301
   80    79 S   HC   _H4_    90     1.07869   108.43443   107.23454
   81    76 S   CA   _C10    50     1.39222   119.95827     0.55708
   82    78 S   CT   _C31    78     1.44680   120.28896   -89.50166
   83    82 S   HC   _H38    79     1.09296   110.09845   179.92598
   84    82 S   HC   _H39    80     1.09358   110.20809    59.97628
   85    82 S   HC   _H40    81     1.09334   110.21572   -60.03457
   86    78 S   CT   _C32    82     1.44697   120.21211    89.82104
   87    86 S   HC   _H41    83     1.09322   110.09396  -179.97202
   88    86 S   HC   _H42    84     1.09339   110.28766    60.03760
   89    86 S   HC   _H43    85     1.09366   110.25607   -59.99244
   90    79 S   CT   _C21    91     1.53694   113.55307   -11.00986
   91    90 S   HC   _H22    92     1.08653   107.50598   159.03806
   92    90 S   HC   _H23    93     1.07801   111.59284   -84.62148
   93    62 S   CA   _C15    51     1.40128   119.15177   172.96781
   94    81 S   N    _N5_    54     1.39802   119.07270  -179.98022
   95    94 S   H    _H19    55     1.02520   116.19248  -179.98022
   96    93 S   OH   _O34    52     1.36616   121.98089    -1.11118
   97    96 S   HO   _H21    53     0.96923   109.99662     0.00000
   98    94 S   C    _C9_    56     1.40174   128.08533     0.03956
   99    98 S   O    _O33    57     1.22689   127.02361     0.18131
  100    98 S   CT1  _C8_    58     1.51246   111.00320  -180.00000
  101   100 S   HC   _H17    59     1.09301   110.58233    59.96922
  102   100 S   HC   _H18    60     1.09343   110.26865   -62.46340
  103   100 S   NP   _N4_    61     1.48226   111.52736   178.83299
  104   103 S   H    _H15    62     1.03059   109.38780   -60.04519
  105   103 S   H    _H16    63     1.03060   109.39592    55.11284
  106   103 S   CT   _C5_    64     1.48875   114.39740   177.57731
  107   106 S   CT   _C4_    65     1.52766   107.70756  -177.35351
  108   107 S   HC   _H6_    66     1.09620   111.38085   -62.27681
  109   107 S   HC   _H7_    67     1.09549   110.89951    57.59471
  110   107 S   HC   _H8_    68     1.09616   111.40183   177.49228
  111   106 S   CT   _C6_    69     1.52824   107.65803   -57.36562
  112   111 S   HC   _H9_    70     1.09585   111.41959    62.26841
  113   111 S   HC   _H10    71     1.09581   111.42162   -58.01131
  114   111 S   HC   _H11    72     1.09588   110.91438  -177.92114
  115   106 S   CT   _C7_    73     1.52793   107.71411    62.61345
  116   115 S   HC   _H12    74     1.09578   111.41590   -62.20116
  117   115 S   HC   _H13    75     1.09585   110.87396    57.65973
  118   115 S   HC   _H14    76     1.09580   111.40068   177.53304
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  18   2   1   1  16   7   1  14   5   6   3  16   2   1   1  15
  17   8   5   1  15  15   5   3   1  11   4  10   8  13   7   3
   2   1   3   2   1   1  15  18  10   4   3  10   4   9   4   3
   8   7   3   2   1   3   2   1   1   2   1   1   5   8   3   1
   1   8   4   9   5   4  15   5   4  12  11   4   3   2   7   3
   2   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    54    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    49    54    55    60    42    38    39  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    41    44    90    49    50    54    55    60    61    63    67    42    43    45    38    39  
   35    36  
   36  
    0  
   40    41    44    48    49    54    55    60    51    42    43    45    46    47    38    39  
   39    40    42    49    54    55    60  
   54  
   41    44    48    53    90    49    50    54    56    51    52    42    43    45  
   44    48    49    51    42  
   43    45    46    47    44    54  
   45    46    47  
   48    53    58    79    90    91    92    49    50    54    55    60    56    57    51    52  
   46    47  
   47  
    0  
   53    58    59    62    73    79    80    90    49    50    54    56    57    51    52  
   50    54    55    60    61    63    67    56    51    52    53    73    79    80    90    91    92  
   54    55    60    51    79    90    91    92  
   52    53    54    56    90  
    0  
   58    59    62    71    93    73    74    75    79    80    90    91    92    56    57  
   55    60    61    63    64    65    66    67    68    69    70    79    90    91    92  
   60    61    63    67    90  
   57    58    79  
    0  
   59    62    71    72    81    93    96    73    79    80    90  
   62    71    93    79  
   61    63    64    65    66    67    68    69    70    90  
   63    64    65    66    67    68    69    70  
   71    72    76    81    93    96    97    94    78    73    74    75    79  
   64    65    66    67    68    69    70  
   65    66    67  
   66    67  
   67  
   68    69    70  
   69    70  
   70  
    0  
   72    76    77    81    93    96    78    82    86    73    74    75    79    80    90  
   76    77    81    93    94    78    82    83    84    85    86    87    88    89    73    74    75    79  
   74    75    79    80    90    91    92    76    78    93  
   75    79    80    90  
   79    80    90  
   77    81    93    96    94    95    98    78    82    86  
   81    93    94    78  
   82    83    84    85    86    87    88    89    81  
   80    90    91    92  
   90    91    92  
   93    96    97    94    95    98    99   100  
   83    84    85    86    87    88    89  
   84    85    86  
   85    86  
   86  
   87    88    89  
   88    89  
   89  
    0  
   91    92  
   92  
    0  
   96    97    94    95    98  
   95    98    99   100   101   102   103    96  
   98    99   100  
   97  
    0  
   99   100   101   102   103   104   105   106  
  100   101   102   103  
  101   102   103   104   105   106   107   111   115  
  102   103   104   105   106  
  103   104   105   106  
  104   105   106   107   108   109   110   111   112   113   114   115   116   117   118  
  105   106   107   111   115  
  106   107   111   115  
  107   108   109   110   111   112   113   114   115   116   117   118  
  108   109   110   111   112   113   114   115   116   117   118  
  109   110   111   115  
  110   111   115  
  111   115  
  112   113   114   115   116   117   118  
  113   114   115  
  114   115  
  115  
  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   0.432500   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  -0.657900   2.0020   1.7750   0.023028004  -0.852763146
   38   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   39   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   40   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.500000   1.8100   1.6000   0.001000000  -1.480495490
   44   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   45   3.2500   0.1700  -0.760000   1.8100   1.6000   0.054801302  -1.445846770
   46   0.5000   0.0300   0.380000   1.5900   1.4000   0.030040813  -0.651083722
   47   0.5000   0.0300   0.380000   1.5900   1.4000   0.030040813  -0.651083722
   48   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   49   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   51   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   52   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   53   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   54   3.5000   0.0660   0.210000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   56   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   57   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   58   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   59   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   60   3.2500   0.1700  -0.100000   2.1950   1.9500   0.003973653   1.685851020
   61   0.5000   0.0300   0.290000   0.9960   0.8600   0.030040813  -0.651083722
   62   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   63   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   67   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   71   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   72   3.5500   0.0700   0.210000   2.5000   1.7750   0.001000000  -0.843144165
   73   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   77   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   78   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   79   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   82   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   92   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   93   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   94   3.2500   0.1700  -0.385000   1.8100   1.6000   0.054801302  -1.445846770
   95   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   96   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   97   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   98   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   99   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
  100   3.5000   0.0660   0.002500   1.9750   1.7500   0.005000000  -0.741685710
  101   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  102   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  103   3.2500   0.1700  -0.032500   2.1950   1.9500   0.003973653   1.685851020
  104   0.5000   0.0300   0.310000   0.9960   0.8600   0.030040813  -0.651083722
  105   0.5000   0.0300   0.310000   0.9960   0.8600   0.030040813  -0.651083722
  106   3.5000   0.0660   0.290000   1.9750   1.7500   0.005000000  -0.741685710
  107   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  108   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  109   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  110   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  111   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  112   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  113   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  114   2.5000   0.0300   0.060000   1.6450   1.4500   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   1.6450   1.4500   0.008598240   0.268726247
  117   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  118   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    54   268.000  1.529
   33    38   320.000  1.410
   37    40   465.000  1.376
   37    42   410.000  1.444
   40    41   745.000  1.250
   40    44   270.000  1.512
   44    48   317.000  1.510
   44    49   268.000  1.529
   44    51   320.000  1.410
   48    53   549.000  1.340
   48    56   510.000  1.338
   53    58   320.000  1.462
   53    79   317.000  1.510
   58    59   570.000  1.229
   58    62   310.000  1.470
   62    71   469.000  1.400
   62    93   469.000  1.400
   71    72   469.000  1.400
   71    73   317.000  1.510
   72    76   469.000  1.400
   72    78   481.000  1.340
   76    77   367.000  1.080
   76    81   469.000  1.400
   81    93   469.000  1.400
   81    94   360.000  1.404
   93    96   450.000  1.364
   96    97   553.000  0.945
   94    95   434.000  1.010
   94    98   490.000  1.335
   98    99   570.000  1.229
   98   100   317.000  1.522
  100   101   340.000  1.090
  100   102   340.000  1.090
  100   103   367.000  1.471
  103   104   434.000  1.010
  103   105   434.000  1.010
  103   106   367.000  1.471
  106   107   268.000  1.529
  106   111   268.000  1.529
  106   115   268.000  1.529
  107   108   340.000  1.090
  107   109   340.000  1.090
  107   110   340.000  1.090
  111   112   340.000  1.090
  111   113   340.000  1.090
  111   114   340.000  1.090
  115   116   340.000  1.090
  115   117   340.000  1.090
  115   118   340.000  1.090
   78    82   382.000  1.448
   78    86   382.000  1.448
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    85   340.000  1.090
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    89   340.000  1.090
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    79   268.000  1.529
   79    80   340.000  1.090
   79    90   268.000  1.529
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    49   268.000  1.529
   49    50   340.000  1.090
   49    54   268.000  1.529
   54    55   340.000  1.090
   54    60   367.000  1.471
   60    61   434.000  1.010
   60    63   367.000  1.471
   60    67   367.000  1.471
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   340.000  1.090
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   56    57   553.000  0.945
   51    52   553.000  0.945
   42    43   570.000  1.229
   42    45   490.000  1.335
   45    46   434.000  1.010
   45    47   434.000  1.010
   38    39   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    54    75.00000  111.63000
   29    33    38    85.00000  114.68000
   33    37    40    70.00000  124.00000
   33    37    42    70.00000  119.70000
   33    54    49    58.35000  112.70000
   33    54    55    37.50000  110.70000
   33    54    60    80.00000  111.20000
   33    38    39    55.00000  108.50000
   37    40    41    65.00000  137.10300
   37    40    44    65.00000  122.18000
   37    42    43    80.00000  125.30000
   37    42    45    80.00000  111.56200
   40    44    48    70.00000  110.12100
   40    44    49    70.00000  112.02700
   40    44    51    90.00000  110.39200
   44    40    41    85.00000  112.85300
   44    48    53    70.00000  124.00000
   44    48    56    90.00000  109.34000
   44    49    90    58.35000  112.70000
   44    49    50    37.50000  110.70000
   44    49    54    58.35000  112.70000
   44    51    52    55.00000  108.50000
   48    53    58    65.00000  118.96000
   48    53    79    70.00000  124.00000
   48    56    57    70.00000  107.45700
   53    58    59    80.00000  123.72100
   53    58    62    65.00000  117.02400
   53    79    73    70.00000  112.02700
   53    79    80    35.00000  109.50000
   53    79    90    70.00000  112.02700
   58    62    71    60.00000  119.52600
   58    62    93    60.00000  119.52600
   62    58    59    75.00000  123.78400
   62    71    72    63.00000  120.00000
   62    71    73    70.00000  120.00000
   62    93    81    63.00000  120.00000
   62    93    96    70.00000  120.00000
   71    72    76    63.00000  120.00000
   71    72    78    70.00000  120.10000
   71    73    74    35.00000  109.50000
   71    73    75    35.00000  109.50000
   71    73    79    70.00000  112.17500
   72    76    77    35.00000  120.00000
   72    76    81    63.00000  120.00000
   72    78    82    50.00000  120.00000
   72    78    86    50.00000  120.00000
   76    81    93    63.00000  120.00000
   76    81    94    70.00000  119.01900
   81    76    77    35.00000  120.00000
   81    93    96    70.00000  120.00000
   81    94    95    45.00000  118.23600
   81    94    98    65.00000  121.96500
   93    62    71    63.00000  120.00000
   93    96    97    35.00000  113.00000
   94    81    93    70.00000  119.01900
   94    98    99    80.00000  122.90000
   94    98   100    70.00000  116.60000
   98    94    95    35.00000  119.80000
   98   100   101    35.00000  109.50000
   98   100   102    35.00000  109.50000
   98   100   103    80.00000  111.20000
  100    98    99    80.00000  120.40000
  100   103   104    35.00000  109.50000
  100   103   105    35.00000  109.50000
  100   103   106    75.00000  113.01200
  102   100   101    33.00000  107.80000
  103   100   101    35.00000  109.50000
  103   100   102    35.00000  109.50000
  103   106   107    80.00000  111.20000
  103   106   111    80.00000  111.20000
  103   106   115    80.00000  111.20000
  105   103   104    35.00000  109.50000
  106   103   104    35.00000  109.50000
  106   103   105    35.00000  109.50000
  106   107   108    37.50000  110.70000
  106   107   109    37.50000  110.70000
  106   107   110    37.50000  110.70000
  106   111   112    37.50000  110.70000
  106   111   113    37.50000  110.70000
  106   111   114    37.50000  110.70000
  106   115   116    37.50000  110.70000
  106   115   117    37.50000  110.70000
  106   115   118    37.50000  110.70000
  109   107   108    33.00000  107.80000
  110   107   108    33.00000  107.80000
  110   107   109    33.00000  107.80000
  111   106   107    58.35000  112.70000
  113   111   112    33.00000  107.80000
  114   111   112    33.00000  107.80000
  114   111   113    33.00000  107.80000
  115   106   107    58.35000  112.70000
  115   106   111    58.35000  112.70000
  117   115   116    33.00000  107.80000
  118   115   116    33.00000  107.80000
  118   115   117    33.00000  107.80000
   78    72    76    70.00000  120.10000
   78    82    83    35.00000  109.50000
   78    82    84    35.00000  109.50000
   78    82    85    35.00000  109.50000
   78    86    87    35.00000  109.50000
   78    86    88    35.00000  109.50000
   78    86    89    35.00000  109.50000
   84    82    83    33.00000  107.80000
   85    82    83    33.00000  107.80000
   85    82    84    33.00000  107.80000
   86    78    82    50.00000  115.00000
   88    86    87    33.00000  107.80000
   89    86    87    33.00000  107.80000
   89    86    88    33.00000  107.80000
   73    71    72    70.00000  120.00000
   73    79    80    37.50000  110.70000
   73    79    90    58.35000  112.70000
   75    73    74    33.00000  107.80000
   79    53    58    65.00000  116.34900
   79    73    74    37.50000  110.70000
   79    73    75    37.50000  110.70000
   79    90    91    37.50000  110.70000
   79    90    92    37.50000  110.70000
   79    90    49    58.35000  112.70000
   90    79    80    37.50000  110.70000
   90    49    50    37.50000  110.70000
   90    49    54    58.35000  112.70000
   92    90    91    33.00000  107.80000
   49    44    48    70.00000  112.02700
   49    90    91    37.50000  110.70000
   49    90    92    37.50000  110.70000
   49    54    55    37.50000  110.70000
   49    54    60    80.00000  111.20000
   54    33    37    70.00000  112.02700
   54    49    50    37.50000  110.70000
   54    60    61    35.00000  109.50000
   54    60    63    75.00000  113.01200
   54    60    67    75.00000  113.01200
   60    54    55    35.00000  109.50000
   60    63    64    35.00000  109.50000
   60    63    65    35.00000  109.50000
   60    63    66    35.00000  109.50000
   60    67    68    35.00000  109.50000
   60    67    69    35.00000  109.50000
   60    67    70    35.00000  109.50000
   63    60    61    35.00000  109.50000
   65    63    64    33.00000  107.80000
   66    63    64    33.00000  107.80000
   66    63    65    33.00000  107.80000
   67    60    61    35.00000  109.50000
   67    60    63    75.00000  113.01200
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   56    48    53    80.00000  121.38400
   51    44    48    90.00000  110.39200
   51    44    49    50.00000  109.50000
   42    37    40    60.00000  120.04000
   42    45    46    35.00000  119.80000
   42    45    47    35.00000  119.80000
   45    42    43    80.00000  122.90000
   47    45    46    35.00000  120.00000
   38    33    37    90.00000  110.39200
   38    33    54    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
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   75    73    79    53   0.15000  1.0 3.0
   75    73    79    80   0.15000  1.0 3.0
   75    73    79    90   0.15000  1.0 3.0
   79    53    58    59  -0.64400  1.0 1.0
   79    53    58    59   0.26850 -1.0 2.0
   79    53   -58    62   1.50000 -1.0 2.0
   79    90   -49    44   0.56750  1.0 1.0
   79    90   -49    44  -0.07550 -1.0 2.0
   79    90   -49    44   0.20000  1.0 3.0
   79    90    49    50   0.15000  1.0 3.0
   79    90    49    54   0.56750  1.0 1.0
   79    90    49    54  -0.07550 -1.0 2.0
   79    90    49    54   0.20000  1.0 3.0
   80    79    90    91   0.15000  1.0 3.0
   80    79    90    92   0.15000  1.0 3.0
   80    79    90    49   0.15000  1.0 3.0
   90    49    54    33   0.56750  1.0 1.0
   90    49    54    33  -0.07550 -1.0 2.0
   90    49    54    33   0.20000  1.0 3.0
   90    49    54    55   0.15000  1.0 3.0
   90    49    54    60   1.36600  1.0 1.0
   90    49    54    60  -0.11450 -1.0 2.0
   90    49    54    60   0.24250  1.0 3.0
   91    90    49    44   0.15000  1.0 3.0
   91    90    49    50   0.15000  1.0 3.0
   91    90    49    54   0.15000  1.0 3.0
   92    90    49    44   0.15000  1.0 3.0
   92    90    49    50   0.15000  1.0 3.0
   92    90    49    54   0.15000  1.0 3.0
   49    44   -48    53   0.09850  1.0 1.0
   49    44   -48    53   0.15250 -1.0 2.0
   49    44   -48    53  -0.50650  1.0 3.0
   49    44    48    56   0.09700  1.0 1.0
   49    44    48    56   0.15600 -1.0 2.0
   49    44    48    56  -0.50800  1.0 3.0
   49    44    51    52  -0.11600  1.0 1.0
   49    44    51    52  -0.09450 -1.0 2.0
   49    44    51    52   0.21250  1.0 3.0
   49    54    60    61   0.17350  1.0 3.0
   49    54    60    63   0.47100  1.0 1.0
   49    54    60    67   0.47100  1.0 1.0
   50    49    54    33   0.15000  1.0 3.0
   50    49    54    55   0.15000  1.0 3.0
   50    49    54    60   0.19200  1.0 3.0
   54    33   -37    40   0.09850  1.0 1.0
   54    33   -37    40   0.15250 -1.0 2.0
   54    33   -37    40  -0.50650  1.0 3.0
   54    33    37    42   0.09700  1.0 1.0
   54    33    37    42   0.15600 -1.0 2.0
   54    33    37    42  -0.50800  1.0 3.0
   54    33    38    39  -0.11600  1.0 1.0
   54    33    38    39  -0.09450 -1.0 2.0
   54    33    38    39   0.21250  1.0 3.0
   54    60    63    64   0.15000  1.0 3.0
   54    60    63    65   0.15000  1.0 3.0
   54    60    63    66   0.15000  1.0 3.0
   54    60    67    68   0.15000  1.0 3.0
   54    60    67    69   0.15000  1.0 3.0
   54    60    67    70   0.15000  1.0 3.0
   55    54    60    61   0.13050  1.0 3.0
   55    54    60    63   0.15000  1.0 3.0
   55    54    60    67   0.15000  1.0 3.0
   61    60    63    64   0.13050  1.0 3.0
   61    60    63    65   0.13050  1.0 3.0
   61    60    63    66   0.13050  1.0 3.0
   61    60    67    68   0.13050  1.0 3.0
   61    60    67    69   0.13050  1.0 3.0
   61    60    67    70   0.13050  1.0 3.0
   63    60    67    68   0.15000  1.0 3.0
   63    60    67    69   0.15000  1.0 3.0
   63    60    67    70   0.15000  1.0 3.0
   67    60    63    64   0.15000  1.0 3.0
   67    60    63    65   0.15000  1.0 3.0
   67    60    63    66   0.15000  1.0 3.0
   56    48    53    58   7.00000 -1.0 2.0
   56    48    53    79   7.00000 -1.0 2.0
   51    44    48    53   0.67800  1.0 1.0
   51    44    48    53   0.47050 -1.0 2.0
   51    44    48    53  -0.62500  1.0 3.0
   51    44    48    56   0.09700  1.0 1.0
   51    44    48    56   0.15600 -1.0 2.0
   51    44    48    56  -0.50800  1.0 3.0
   51    44    49    90   0.86500  1.0 1.0
   51    44    49    90  -0.17500 -1.0 2.0
   51    44    49    90   0.20800  1.0 3.0
   51    44    49    50   0.23400  1.0 3.0
   51    44    49    54   0.86500  1.0 1.0
   51    44    49    54  -0.17500 -1.0 2.0
   51    44    49    54   0.20800  1.0 3.0
   42    37    40    41   7.00000 -1.0 2.0
   42    37    40    44   7.00000 -1.0 2.0
   43    42    45    46   2.45000 -1.0 2.0
   43    42    45    47   2.45000 -1.0 2.0
   38    33    37    40   0.67800  1.0 1.0
   38    33    37    40   0.47050 -1.0 2.0
   38    33    37    40  -0.62500  1.0 3.0
   38    33    37    42   0.09700  1.0 1.0
   38    33    37    42   0.15600 -1.0 2.0
   38    33    37    42  -0.50800  1.0 3.0
   38    33    54    49   0.86500  1.0 1.0
   38    33    54    49  -0.17500 -1.0 2.0
   38    33    54    49   0.20800  1.0 3.0
   38    33    54    55   0.23400  1.0 3.0
   38    33    54    60   1.69300  1.0 1.0
   38    33    54    60  -0.48450 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    42    37    40   1.10000 -1.0 2.0
   44    41    40    37   1.10000 -1.0 2.0
   44    56    48    53   1.10000 -1.0 2.0
   58    79    53    48   1.10000 -1.0 2.0
   53    62    58    59  10.50000 -1.0 2.0
   71    93    62    58   4.00000 -1.0 2.0
   72    73    71    62   4.00000 -1.0 2.0
   76    78    72    71   4.00000 -1.0 2.0
   81    77    76    72   1.10000 -1.0 2.0
   93    94    81    76   4.00000 -1.0 2.0
   81    96    93    62   4.00000 -1.0 2.0
   95    98    94    81   1.00000 -1.0 2.0
   94   100    98    99  10.50000 -1.0 2.0
   86    72    78    82   1.00000 -1.0 2.0
   37    45    42    43  10.50000 -1.0 2.0
   47    42    45    46   1.00000 -1.0 2.0
END
