* LIGAND DATABASE FILE (OPLS2005)
*
001     119   120    215    308     621
    1     0 S   NP   _N1_     1    28.80120    96.55635   -25.54283
    2     1 S   H    _HN1     2     1.02828    40.63697  -173.65084
    3     1 S   H    _H1_     3     1.02785   112.97679   -82.59242
    4     1 S   H    _H2_     4     1.02950    67.25181    18.56003
    5     1 S   CT   _CA1     5     1.50115   132.65259   115.88067
    6     5 S   HC   _HA1     6     1.09572   105.19075   100.25208
    7     5 S   CO3  _C1_     7     1.53792   112.48185   -19.97432
    8     7 S   O2Z  _O11     8     1.26370   115.00714   -41.86187
    9     7 S   O2Z  _O12     9     1.26242   114.95614   137.27754
   10     5 S   CT   _CB1    10     1.53083   107.41771  -141.75370
   11    10 S   HC   HB11    11     1.09832   109.37545   -49.57791
   12    10 S   HC   HB12    12     1.09813   110.44190    67.03568
   13    10 S   CT   _CG1    13     1.52986   112.60766  -170.55431
   14    13 S   HC   HG11    14     1.09582   110.62522   -65.70799
   15    13 S   HC   HG12    15     1.09671   109.78564    53.51964
   16    13 S   C    _CD1    16     1.51803   112.24809   173.97950
   17    16 S   O    _OE1    17     1.22726   123.29414     6.80279
   18    16 S   N    _N2_    18     1.38647   111.64034  -173.24788
   19    18 S   H    _HN2    19     1.01580   118.94524     1.91029
   20    18 S   CT1  _CA2    20     1.46216   123.45019   177.79061
   21    20 S   HC   _HA2    21     1.09733   109.32860     4.13508
   22    20 S   C    _C2_    22     1.53605   108.96301  -111.42841
   23    22 S   O    _O2_    23     1.23073   122.23988  -150.36038
   24    20 S   CT   _CB2    32     1.53300   111.37847   126.11341
   25    24 S   HC   HB21    33     1.09567   109.85687    55.36648
   26    24 S   HC   HB22    34     1.09431   110.10896   174.65016
   27    22 S   N    _N3_    24     1.38307   113.83374    37.20485
   28    27 S   H    _HN3    25     1.01571   119.59222    -3.42045
   29    24 S   S    _SG2    35     1.82810   111.48268   -65.58272
   30    27 S   CT   _CA3    26     1.45281   123.21737   177.09883
   31    30 S   HC   HA31    27     1.09549   107.52968   -64.16369
   32    30 S   HC   HA32    28     1.09557   107.96424    52.27204
   33    29 S   CT   _C16    36     1.84483    99.89243   168.76879
   34    33 S   HC   _H9_    37     1.09123   105.62473   -48.22488
   35    30 S   CO3  _C3_    29     1.52957   114.07830   174.26404
   36    35 S   O2Z  _O31    30     1.26378   116.07832    -0.36045
   37    35 S   O2Z  _O32    31     1.26431   114.41132   179.68534
   38    33 S   CM   _C15    38     1.50511   108.74318    70.57249
   39    38 S   HC   _H19    39     1.09082   115.21780    62.53982
   40    33 S   CT   _C17    74     1.55382   112.58637  -165.03622
   41    40 S   HC   _H10    75     1.09918   107.96634  -178.46532
   42    38 S   CM   _C14    40     1.34173   129.73681  -115.72408
   43    42 S   HC   _H18    41     1.09165   114.91776   178.27660
   44    40 S   CT   _C27    76     1.53285   112.37395    65.05919
   45    44 S   HC   _H26    77     1.09455   112.42512   -66.60083
   46    44 S   HC   _H27    78     1.09521   110.47027   174.02965
   47    44 S   HC   _H28    79     1.09495   110.82847    54.65075
   48    42 S   CT   _C13    42     1.50719   132.48739     0.42197
   49    48 S   HC   _H8_    43     1.10002   107.17558  -165.87499
   50    48 S   CT   _C12    44     1.55035   120.00466   -44.17904
   51    50 S   HC   _H7_    45     1.09577   108.22277    79.18380
   52    48 S   OS   _O37   115     1.44230   108.23231    78.06704
   53    50 S   CM   _C11    46     1.52286   118.19926   -47.38372
   54    50 S   OS   _O38   109     1.46283   105.06702  -165.03619
   55    52 S   CT   _C28   116     1.42221   113.63019    82.12100
   56    55 S   HC   _H29   117     1.09318   108.17936   179.56614
   57    55 S   HC   _H30   118     1.09413   110.44296    61.07550
   58    55 S   HC   _H31   119     1.09365   110.99539   -61.54672
   59    53 S   CM   _C10    47     1.35139   118.67608   148.85166
   60    59 S   HC   _H17    48     1.09043   117.46229    -1.12361
   61    53 S   CT   _C30   105     1.50496   117.29224   -36.49223
   62    61 S   HC   _H34   106     1.09503   110.29538   -47.61673
   63    61 S   HC   _H35   107     1.09265   113.26416  -167.16523
   64    61 S   HC   _H36   108     1.09318   110.86485    72.73493
   65    54 S   CO4  _C29   110     1.36041   118.62725  -130.54982
   66    65 S   O    _O39   111     1.22485   125.98417    -0.54212
   67    59 S   CT   _C9_    49     1.52133   127.71851   175.41119
   68    67 S   HC   _H6_    50     1.09531   107.94519    36.55359
   69    65 S   N    _N5_   112     1.36884   110.05595   179.57204
   70    69 S   H    _H32   113     1.01323   120.98978   179.94405
   71    69 S   H    _H33   114     1.01318   121.05966    -0.00000
   72    67 S   CT   _C8_    51     1.56429   109.64602   154.30983
   73    72 S   HC   _H5_    52     1.09888   108.12983   -35.29043
   74    67 S   CT   _C31   101     1.53627   107.80943   -81.10405
   75    74 S   HC   _H37   102     1.09554   112.09636   -64.07083
   76    74 S   HC   _H38   103     1.09113   111.83754   174.21318
   77    74 S   HC   _H39   104     1.09583   111.32213    55.52532
   78    72 S   CT   _C7_    53     1.55965   115.17130  -155.24729
   79    78 S   HC   _H4_    54     1.09628   109.44317  -162.21337
   80    72 S   OS   _O40    96     1.43813   108.45791    81.46958
   81    78 S   CT   _C6_    55     1.54275   109.79852    79.83097
   82    81 S   HC   _H15    56     1.09717   108.24179    63.38847
   83    81 S   HC   _H16    57     1.09559   108.02856   -52.15693
   84    78 S   OS   _O41    91     1.42867   112.34610   -40.88418
   85    80 S   CT   _C32    97     1.42173   113.40404  -146.84177
   86    85 S   HC   _H40    98     1.09328   108.19252  -178.23209
   87    85 S   HC   _H41    99     1.09432   110.26205    63.36925
   88    85 S   HC   _H42   100     1.09310   111.31258   -59.10054
   89    81 S   CT   _C5_    58     1.54864   116.39561  -173.28948
   90    89 S   HC   _H3_    59     1.09880   108.55441    66.52810
   91    84 S   CT   _C33    92     1.42302   113.31345   -89.67856
   92    91 S   HC   _H43    93     1.09336   108.10737   179.43421
   93    91 S   HC   _H44    94     1.09262   111.30790    60.47909
   94    91 S   HC   _H45    95     1.09373   110.64100   -62.06408
   95    89 S   CT   _C24    60     1.56073   112.26546  -173.94725
   96    95 S   HC   _H11    61     1.09795   107.96980    73.82300
   97    89 S   CT   _C4_    87     1.53726   111.89843   -51.14346
   98    97 S   HC   _H12    88     1.09528   110.97813   -56.91410
   99    97 S   HC   _H13    89     1.09490   111.42001  -177.22625
  100    97 S   HC   _H14    90     1.09270   111.60241    63.77220
  101    95 S   CM   _C23    62     1.51510   113.07417   -48.35488
  102    95 S   OS   _O34    82     1.44005   107.32671  -169.86750
  103   101 S   CM   _C22    63     1.34227   125.03881   -85.66058
  104   103 S   HC   _H21    64     1.08716   119.88677     1.42629
  105   102 S   CT   _C25    83     1.42307   113.00556  -151.93079
  106   105 S   HC   _H22    84     1.09327   108.20225  -178.24721
  107   105 S   HC   _H23    85     1.09419   110.31064    63.24497
  108   105 S   HC   _H24    86     1.09385   111.06191   -59.19518
  109   103 S   CM   _C21    65     1.44021   123.44112  -178.68940
  110   109 S   CM   _C20    66     1.33741   122.91196    -7.25474
  111   110 S   HC   _H20    67     1.08348   122.68265  -177.13700
  112   109 S   OH   _O36    80     1.37664   114.23948   174.56646
  113   112 S   HO   _H25    81     0.97275   108.37443   179.42122
  114   110 S   CD   _C19    68     1.48262   119.07324     0.71272
  115   101 S   CO4  _C26    69     1.49249   117.41746    96.63947
  116   115 S   O    _O35    70     1.22069   121.87798    12.68862
  117   114 S   NI   _N4_    71     1.29941   118.70537  -166.71325
  118   117 S   C    _C18    72     1.37455   121.09447   178.68806
  119   118 S   O    _O33    73     1.22801   123.69067    84.75663
  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
  15   7   2   1   1  11   4  10   7   9   4   6   3   2   1  13
   6  15   6   6  12   7   3   2   1   1  15   5   4   2   1   1
   4   3  13   8   2   1   1  18   7   5   2   1   1  15   7   6
  14   6   5   5   3   2   1   1  12   8   3   2   1   1  17   6
   5   2   1   1  11   6   9   4   3   2   1   1   7   8   4   2
   1   5   3   1   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   118    40    41    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    43    48   117   118   119    40    41    44    45    46    47  
   38    39    42   118    40    41    44  
   36    37  
   37  
    0  
   39    42    43    48    49    50   118    40    41    44    52  
   42    43    48    40  
   41    44    45    46    47    42   114   117   118   119  
   44    45    46    47   117   118   119  
   43    48    49    50    51    53    54    52    55  
   48    49    50    52  
   45    46    47   117   118   119  
   46    47   118  
   47   118  
  118  
   49    50    51    53    59    61    54    65    52    55    56    57    58  
   50    51    53    54    52    55  
   51    53    59    60    67    61    62    63    64    54    65    66    69    52    55  
   53    59    61    54    65    52  
   55    56    57    58    53    54  
   59    60    67    68    72    74    61    62    63    64    54    65  
   65    66    69    70    71    59    61  
   56    57    58  
   57    58  
   58  
    0  
   60    67    68    72    73    78    80    74    75    76    77    61    62    63    64  
   67    68    72    74    61  
   62    63    64    67  
   63    64  
   64  
    0  
   66    69    70    71  
   69    70    71  
   68    72    73    78    79    81    84    80    85    74    75    76    77  
   72    73    78    80    74    75    76    77  
   70    71  
   71  
    0  
   73    78    79    81    82    83    89    84    91    80    85    86    87    88    74    75    76    77  
   78    79    81    84    80    85    74  
   75    76    77    78    80  
   76    77  
   77  
    0  
   79    81    82    83    89    90    95    97    84    91    92    93    94    80    85  
   81    82    83    89    84    91    80  
   85    86    87    88    81    84  
   82    83    89    90    95    96   101   102    97    98    99   100    84    91  
   83    89    90    95    97    84  
   89    90    95    97    84  
   91    92    93    94    89  
   86    87    88  
   87    88  
   88  
    0  
   90    95    96   101   103   115   102   105    97    98    99   100  
   95    96   101   102    97    98    99   100  
   92    93    94  
   93    94  
   94  
    0  
   96   101   103   104   109   114   115   116   102   105   106   107   108    97    98    99   100  
  101   103   115   102   105    97  
   98    99   100   101   102  
   99   100  
  100  
    0  
  103   104   109   110   114   115   116   117   112   102   105  
  105   106   107   108   103   115  
  104   109   110   111   114   115   116   112   113  
  109   110   115   112  
  106   107   108  
  107   108  
  108  
    0  
  110   111   114   115   117   112   113  
  111   114   115   116   117   118   112   113  
  114   115   117   112  
  113   114  
    0  
  115   116   117   118   119  
  116   117   118  
  117  
  118   119  
  119  
    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   3.5000   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  -0.184000   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  -0.180000   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   0.239000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660   0.289000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   52   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   53   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   54   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   55   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   60   2.4200   0.0300   0.115000   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   3.7500   0.1050   0.632500   1.9250   1.7000   0.001000000  -0.126889456
   66   2.9600   0.2100  -0.497000   1.8100   1.6000   0.001000000  -1.480495490
   67   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.2500   0.1700  -0.883900   1.8100   1.6000   0.054801302  -1.445846770
   70   0.5000   0.0300   0.414200   1.5900   1.4000   0.030040813  -0.651083722
   71   0.5000   0.0300   0.414200   1.5900   1.4000   0.030040813  -0.651083722
   72   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   74   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   80   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   81   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   85   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   87   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   88   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   89   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   93   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   94   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   95   3.5000   0.0660   0.239000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   97   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  101   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
  102   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
  103   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
  104   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  105   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
  106   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  107   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  108   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  109   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
  110   3.5500   0.0760  -0.118300   2.0020   1.7750   0.023028004  -0.852763146
  111   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  112   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
  113   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
  114   3.7500   0.1050   0.393000   2.0020   1.7750   0.023028004  -0.852763146
  115   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
  116   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
  117   3.2800   0.1700  -0.512200   1.8540   1.6400   0.005000000   0.000000000
  118   3.7500   0.1050   0.345000   2.1120   1.8750   0.001000000  -0.126889456
  119   2.9600   0.2100  -0.222500   1.6780   1.4800   0.001000000  -0.126889456
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   549.000  1.340
   42    43   340.000  1.080
   42    48   317.000  1.510
   48    49   340.000  1.090
   48    50   268.000  1.529
   48    52   320.000  1.410
   50    51   340.000  1.090
   50    53   317.000  1.510
   50    54   320.000  1.410
   53    59   549.000  1.340
   53    61   317.000  1.510
   59    60   340.000  1.080
   59    67   317.000  1.510
   67    68   340.000  1.090
   67    72   268.000  1.529
   67    74   268.000  1.529
   72    73   340.000  1.090
   72    78   268.000  1.529
   72    80   320.000  1.410
   78    79   340.000  1.090
   78    81   268.000  1.529
   78    84   320.000  1.410
   81    82   340.000  1.090
   81    83   340.000  1.090
   81    89   268.000  1.529
   89    90   340.000  1.090
   89    95   268.000  1.529
   89    97   268.000  1.529
   95    96   340.000  1.090
   95   101   317.000  1.510
   95   102   320.000  1.410
  101   103   549.000  1.340
  101   115   320.000  1.462
  103   104   340.000  1.080
  103   109   380.000  1.444
  109   110   549.000  1.340
  109   112   510.000  1.338
  110   111   340.000  1.080
  110   114   320.000  1.464
  114   115   275.000  1.494
  114   117   500.000  1.261
  115   116   570.000  1.229
  117   118   415.000  1.368
  118   119   570.000  1.229
  118    40   317.000  1.522
   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
  112   113   553.000  0.945
  102   105   320.000  1.410
  105   106   340.000  1.090
  105   107   340.000  1.090
  105   108   340.000  1.090
   97    98   340.000  1.090
   97    99   340.000  1.090
   97   100   340.000  1.090
   84    91   320.000  1.410
   91    92   340.000  1.090
   91    93   340.000  1.090
   91    94   340.000  1.090
   80    85   320.000  1.410
   85    86   340.000  1.090
   85    87   340.000  1.090
   85    88   340.000  1.090
   74    75   340.000  1.090
   74    76   340.000  1.090
   74    77   340.000  1.090
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
   54    65   214.000  1.327
   65    66   570.000  1.229
   65    69   435.000  1.380
   69    70   434.000  1.010
   69    71   434.000  1.010
   52    55   320.000  1.410
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   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   118    63.00000  111.10000
   33    40    41    37.50000  110.70000
   33    40    44    58.35000  112.70000
   38    33    34    35.00000  109.50000
   38    42    43    35.00000  120.00000
   38    42    48    70.00000  124.00000
   42    38    39    35.00000  120.00000
   42    48    49    35.00000  109.50000
   42    48    50    70.00000  112.02700
   42    48    52    85.00000  110.90400
   48    42    43    35.00000  117.00000
   48    50    51    37.50000  110.70000
   48    50    53    70.00000  112.02700
   48    50    54    50.00000  109.50000
   48    52    55    60.00000  109.50000
   50    48    49    37.50000  110.70000
   50    53    59    70.00000  124.00000
   50    53    61    65.00000  117.92700
   50    54    65    83.00000  116.90000
   53    50    51    35.00000  109.50000
   53    59    60    35.00000  120.00000
   53    59    67    70.00000  124.00000
   53    61    62    35.00000  109.50000
   53    61    63    35.00000  109.50000
   53    61    64    35.00000  109.50000
   59    67    68    35.00000  109.50000
   59    67    72    70.00000  112.02700
   59    67    74    70.00000  112.02700
   67    59    60    35.00000  117.00000
   67    72    73    37.50000  110.70000
   67    72    78    58.35000  112.70000
   67    72    80    50.00000  109.50000
   67    74    75    37.50000  110.70000
   67    74    76    37.50000  110.70000
   67    74    77    37.50000  110.70000
   72    67    68    37.50000  110.70000
   72    78    79    37.50000  110.70000
   72    78    81    58.35000  112.70000
   72    78    84    50.00000  109.50000
   72    80    85    60.00000  109.50000
   78    72    73    37.50000  110.70000
   78    81    82    37.50000  110.70000
   78    81    83    37.50000  110.70000
   78    81    89    58.35000  112.70000
   78    84    91    60.00000  109.50000
   81    78    79    37.50000  110.70000
   81    89    90    37.50000  110.70000
   81    89    95    58.35000  112.70000
   81    89    97    58.35000  112.70000
   83    81    82    33.00000  107.80000
   89    81    82    37.50000  110.70000
   89    81    83    37.50000  110.70000
   89    95    96    37.50000  110.70000
   89    95   101    70.00000  112.02700
   89    95   102    50.00000  109.50000
   89    97    98    37.50000  110.70000
   89    97    99    37.50000  110.70000
   89    97   100    37.50000  110.70000
   95    89    90    37.50000  110.70000
   95   101   103    70.00000  124.00000
   95   101   115    65.00000  116.34900
   95   102   105    60.00000  109.50000
  101    95    96    35.00000  109.50000
  101   103   104    35.00000  120.00000
  101   103   109    70.00000  123.01800
  101   115   114    65.00000  118.65900
  101   115   116    80.00000  123.72100
  103   109   110    70.00000  123.01800
  103   109   112    80.00000  121.38400
  109   103   104    35.00000  120.00000
  109   110   111    35.00000  120.00000
  109   110   114    60.00000  120.31500
  109   112   113    70.00000  107.45700
  110   114   115    65.00000  118.96000
  110   114   117    70.00000  121.86000
  114   110   111    40.00000  114.85300
  114   115   116    75.00000  122.07900
  114   117   118    80.00000  110.69000
  115   101   103    65.00000  118.96000
  117   114   115    60.00000  126.98800
  117   118   119    80.00000  126.08800
  117   118    40    80.00000  113.45100
  118    40    41    35.00000  109.50000
  118    40    44    63.00000  111.10000
   40    33    34    37.50000  110.70000
   40    33    38    70.00000  112.02700
   40   118   119    80.00000  120.40000
   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
  112   109   110    80.00000  121.38400
  102    95    96    35.00000  109.50000
  102    95   101    85.00000  110.90400
  102   105   106    35.00000  109.50000
  102   105   107    35.00000  109.50000
  102   105   108    35.00000  109.50000
  107   105   106    33.00000  107.80000
  108   105   106    33.00000  107.80000
  108   105   107    33.00000  107.80000
   97    89    90    37.50000  110.70000
   97    89    95    58.35000  112.70000
   99    97    98    33.00000  107.80000
  100    97    98    33.00000  107.80000
  100    97    99    33.00000  107.80000
   84    78    79    35.00000  109.50000
   84    78    81    50.00000  109.50000
   84    91    92    35.00000  109.50000
   84    91    93    35.00000  109.50000
   84    91    94    35.00000  109.50000
   93    91    92    33.00000  107.80000
   94    91    92    33.00000  107.80000
   94    91    93    33.00000  107.80000
   80    72    73    35.00000  109.50000
   80    72    78    50.00000  109.50000
   80    85    86    35.00000  109.50000
   80    85    87    35.00000  109.50000
   80    85    88    35.00000  109.50000
   87    85    86    33.00000  107.80000
   88    85    86    33.00000  107.80000
   88    85    87    33.00000  107.80000
   74    67    68    37.50000  110.70000
   74    67    72    58.35000  112.70000
   76    74    75    33.00000  107.80000
   77    74    75    33.00000  107.80000
   77    74    76    33.00000  107.80000
   61    53    59    70.00000  124.00000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
   54    50    51    35.00000  109.50000
   54    50    53    85.00000  110.90400
   54    65    66    83.00000  123.40000
   54    65    69   110.00000  108.75700
   65    69    70    50.00000  116.34900
   65    69    71    50.00000  116.34900
   69    65    66    85.00000  125.96000
   71    69    70    35.00000  120.00000
   52    48    49    35.00000  109.50000
   52    48    50    50.00000  109.50000
   52    55    56    35.00000  109.50000
   52    55    57    35.00000  109.50000
   52    55    58    35.00000  109.50000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    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
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
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   97    89    95    96   0.15000  1.0 3.0
   97    89    95   101   0.34400  1.0 1.0
   97    89    95   101   0.09450 -1.0 2.0
   97    89    95   101   0.11100  1.0 3.0
   97    89    95   102   0.62750  1.0 1.0
   97    89    95   102  -0.30950 -1.0 2.0
   97    89    95   102   0.27300  1.0 3.0
   84    78    81    82   0.23400  1.0 3.0
   84    78    81    83   0.23400  1.0 3.0
   84    78    81    89   0.62750  1.0 1.0
   84    78    81    89  -0.30950 -1.0 2.0
   84    78    81    89   0.27300  1.0 3.0
   80    72    78    79   0.23400  1.0 3.0
   80    72    78    81   0.62750  1.0 1.0
   80    72    78    81  -0.30950 -1.0 2.0
   80    72    78    81   0.27300  1.0 3.0
   80    72    78    84   1.11900  1.0 1.0
   80    72    78    84  -1.16350 -1.0 2.0
   80    72    78    84  -0.34150  1.0 3.0
   74    67    72    73   0.15000  1.0 3.0
   74    67    72    78   0.56750  1.0 1.0
   74    67    72    78  -0.07550 -1.0 2.0
   74    67    72    78   0.20000  1.0 3.0
   74    67    72    80   0.62750  1.0 1.0
   74    67    72    80  -0.30950 -1.0 2.0
   74    67    72    80   0.27300  1.0 3.0
   61    53    59    60   7.00000 -1.0 2.0
   61    53    59    67   7.00000 -1.0 2.0
   54    50    53    59   0.39000  1.0 1.0
   54    50    53    59  -0.05800 -1.0 2.0
   54    50    53    59  -0.55150  1.0 3.0
   54    50    53    61   0.09700  1.0 1.0
   54    50    53    61   0.15600 -1.0 2.0
   54    50    53    61  -0.50800  1.0 3.0
   54    65    69    70   2.56700 -1.0 2.0
   54    65    69    71   2.56700 -1.0 2.0
   66    65    69    70   2.45000 -1.0 2.0
   66    65    69    71   2.45000 -1.0 2.0
   52    48    50    51   0.23400  1.0 3.0
   52    48    50    53   0.61850  1.0 1.0
   52    48    50    53  -0.22750 -1.0 2.0
   52    48    50    53   0.15300  1.0 3.0
   52    48    50    54   1.11900  1.0 1.0
   52    48    50    54  -1.16350 -1.0 2.0
   52    48    50    54  -0.34150  1.0 3.0
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
   36    30    35    37  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
   50    61    53    59   1.10000 -1.0 2.0
   67    60    59    53   1.10000 -1.0 2.0
   95   115   101   103   1.10000 -1.0 2.0
  109   104   103   101   1.10000 -1.0 2.0
  103   112   109   110   1.10000 -1.0 2.0
  114   111   110   109   1.10000 -1.0 2.0
  110   115   114   117  10.50000 -1.0 2.0
  101   114   115   116  10.50000 -1.0 2.0
  117    40   118   119  10.50000 -1.0 2.0
   54    69    65    66  10.50000 -1.0 2.0
   71    65    69    70   1.00000 -1.0 2.0
END
