* LIGAND DATABASE FILE (OPLS2005)
*
001     116   119    221    349     648
    1     0 S   NP   _N1_     1    31.96991   100.54779   -15.13042
    2     1 S   H    _HN1     2     1.02835    89.22395   147.88320
    3     1 S   H    _H1_     3     1.02784    51.83146   -98.48288
    4     1 S   H    _H2_     4     1.02951    68.53877    39.13860
    5     1 S   CT   _CA1     5     1.50137   158.66529   -52.26927
    6     5 S   HC   _HA1     6     1.09589   105.17005   -99.21882
    7     5 S   CO3  _C1_     7     1.53667   112.36140   140.80393
    8     7 S   O2Z  _O11     8     1.26338   115.02989   -45.57009
    9     7 S   O2Z  _O12     9     1.26215   114.88032   133.40479
   10     5 S   CT   _CB1    10     1.53051   107.37452    18.42415
   11    10 S   HC   HB11    11     1.09816   108.94688   -52.38791
   12    10 S   HC   HB12    12     1.09815   110.59171    64.01750
   13    10 S   CT   _CG1    13     1.52998   112.75676  -173.61755
   14    13 S   HC   HG11    14     1.09604   110.38033   -67.92233
   15    13 S   HC   HG12    15     1.09665   110.05248    51.20369
   16    13 S   C    _CD1    16     1.51854   112.27841   171.00888
   17    16 S   O    _OE1    17     1.22727   123.31540    -6.23439
   18    16 S   N    _N2_    18     1.38491   111.63269   174.68795
   19    18 S   H    _HN2    19     1.01639   119.25465    -1.78443
   20    18 S   CT1  _CA2    20     1.45888   123.75502   176.69571
   21    20 S   HC   _HA2    21     1.09726   109.19549    -8.22934
   22    20 S   C    _C2_    22     1.53635   108.40673  -123.45963
   23    22 S   O    _O2_    23     1.23061   122.33445  -152.88146
   24    20 S   CT   _CB2    32     1.53349   112.13195   114.07025
   25    24 S   HC   HB21    33     1.09482   111.33839    57.20739
   26    24 S   HC   HB22    34     1.09573   109.53289   174.64379
   27    22 S   N    _N3_    24     1.38363   113.67751    34.63886
   28    27 S   H    _HN3    25     1.01616   119.35687    -3.55743
   29    24 S   S    _SG2    35     1.82901   112.91633   -67.72998
   30    27 S   CT   _CA3    26     1.45240   123.26140   177.85516
   31    30 S   HC   HA31    27     1.09542   107.54105   -65.13163
   32    30 S   HC   HA32    28     1.09561   107.95057    51.33405
   33    29 S   CT   _C35    36     1.84200   100.61142    93.93068
   34    33 S   HC   _H3_    37     1.09219   107.57446   -46.86657
   35    30 S   CO3  _C3_    29     1.52946   114.06187   173.30672
   36    35 S   O2Z  _O31    30     1.26376   116.06205     1.15250
   37    35 S   O2Z  _O32    31     1.26426   114.42179  -178.77651
   38    33 S   CM   _C12    38     1.50784   107.49356  -164.72379
   39    38 S   HC   _H46    39     1.08896   117.32936   -63.59137
   40    33 S   CM   _C13    56     1.50934   109.52439    74.41621
   41    40 S   HC   _H47    57     1.09216   115.38953    46.64639
   42    38 S   CM   _C10    40     1.34246   123.14897   116.59767
   43    42 S   HC   _H44    41     1.08717   119.51172     0.11014
   44    40 S   CMA  _C14    58     1.35659   126.98443  -133.07334
   45    44 S   OM   _O33    59     1.26538   123.08152   177.98016
   46    42 S   CM   _C9_    42     1.44402   123.35741  -179.80021
   47    46 S   HC   _H43    43     1.08697   117.44781     1.05332
   48    44 S   OS   _O38    60     1.42100   111.34647    -1.86551
   49    46 S   CM   _C11    44     1.34127   122.85809  -179.19424
   50    49 S   HC   _H45    45     1.08779   119.88922     0.73489
   51    48 S   C3T  _C24    61     1.45954   119.55338  -168.23024
   52    49 S   CT   _C33    46     1.50162   123.77076  -179.82306
   53    52 S   HC   _H76    47     1.09673   107.94940  -119.05741
   54    52 S   HC   _H77    48     1.09684   111.05744    -2.58589
   55    51 S   C3T  _C20    62     1.51237   120.83995    60.15260
   56    55 S   HC   _H53    63     1.08561   115.50241   -12.01273
   57    52 S   CT   _C34    49     1.53085   112.82225   120.82795
   58    57 S   HC   _H78    50     1.09680   110.15368    56.65029
   59    57 S   HC   _H79    51     1.09659   108.57617   173.24695
   60    55 S   CT   _C18    64     1.51981   120.57687  -151.56185
   61    60 S   HC   _H51    65     1.09544   105.49473   -84.13148
   62    51 S   C3T  _C25   108     1.54801   110.58601   126.29912
   63    57 S   CT   _C31    52     1.52240   113.22299   -66.05822
   64    63 S   HC   _H71    53     1.09466   110.98490   -56.60313
   65    63 S   HC   _H72    54     1.09430   111.53063    64.39231
   66    63 S   HC   _H73    55     1.09472   110.06094  -176.11506
   67    60 S   CM   _C5_    66     1.51998   112.92362   163.88686
   68    67 S   HC   _H42    67     1.08871   115.75912   -14.54459
   69    60 S   CT   _C23    81     1.57867   111.56823    31.99970
   70    62 S   CT   _C29   109     1.51703   118.68708   -10.39319
   71    70 S   HC   _H65   110     1.09431   110.03448    78.20873
   72    70 S   HC   _H66   111     1.09477   112.49822   -42.43085
   73    70 S   HC   _H67   112     1.09518   110.44732  -162.20217
   74    62 S   CT   _C30   113     1.50865   120.50802   132.90822
   75    74 S   HC   _H68   114     1.09488   109.85894   -87.56183
   76    74 S   HC   _H69   115     1.09547   110.02473   153.78104
   77    74 S   HC   _H70   116     1.08856   114.66526    32.86509
   78    67 S   CM   _C7_    68     1.35046   126.19311   160.79404
   79    69 S   CT   _C21    82     1.56973   106.67597   -59.01846
   80    79 S   HC   _H54    83     1.09656   107.64699   -59.23794
   81    69 S   OH   _O36    97     1.43134   108.03035    58.49717
   82    81 S   HO   _H81    98     0.97054   108.91711  -176.21183
   83    78 S   CT   _C16    69     1.52279   125.69272     7.75320
   84    83 S   HC   _H48    70     1.09919   107.56622   138.02266
   85    83 S   HC   _H49    71     1.09743   108.93067  -107.90214
   86    51 S   CT   _C22    84     1.51390   112.59452   -90.11666
   87    86 S   HC   _H55    85     1.09817   107.93183    33.97020
   88    79 S   CT   _C28    93     1.54102   115.97320  -175.77108
   89    88 S   HC   _H62    94     1.09373   112.05565   -48.86951
   90    88 S   HC   _H63    95     1.09610   111.26141  -168.94125
   91    88 S   HC   _H64    96     1.09187   111.46267    73.98297
   92    78 S   CT   _C32   103     1.50970   119.66764  -175.19014
   93    92 S   HC   _H74   104     1.09507   112.27386     1.41319
   94    92 S   HC   _H75   105     1.09521   110.18022  -119.10869
   95    83 S   CT   _C19    72     1.53376   117.24344    16.28901
   96    95 S   HC   _H52    73     1.09662   110.94546   -86.65061
   97    86 S   OS   _O39    86     1.45235   108.99643   -84.13652
   98    92 S   OH   _O37   106     1.42137   109.34083   121.34193
   99    98 S   HO   _H82   107     0.97219   106.98856   179.19400
  100    95 S   CO4  _C8_    74     1.50972   112.93603   154.80705
  101   100 S   O    _O34    75     1.22206   125.14300    49.18768
  102    97 S   CO4  _C15    87     1.35956   118.61838    87.87804
  103   102 S   O    _O35    88     1.22254   126.76755     1.88938
  104   100 S   CM   _C6_    76     1.47378   111.33070  -132.53237
  105   102 S   CT   _C27    89     1.49828   109.38812  -177.54992
  106   105 S   HC   _H59    90     1.09282   109.89407   -59.28863
  107   105 S   HC   _H60    91     1.09325   109.34981  -178.27036
  108   105 S   HC   _H61    92     1.09295   109.75514    62.68320
  109   104 S   CM   _C4_    77     1.33652   105.79251     6.58630
  110   109 S   HC   _H41    78     1.08289   122.72375   176.99606
  111   104 S   CT   _C26    99     1.47765   123.98819  -174.75903
  112   111 S   HC   _H56   100     1.09443   110.57455   -58.64034
  113   111 S   HC   _H57   101     1.09475   111.40345  -178.66206
  114   111 S   HC   _H58   102     1.09443   110.47211    61.39644
  115    95 S   CT   _C17    79     1.53888   112.40498    39.61437
  116   115 S   HC   _H50    80     1.10207   109.62844    23.92475
  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   9   4   6   3   6   3   6   2   7   3  11
   8   4  22   9   5   4  22   8   6   5   4  20   8  14   3   2
   1   1  14   4  21   8   3   2   1   4   2   1   1  12  15   9
   7   1  14   6   5  10   3   5   2   1   1   5   3   2   9   6
   6   1   1  10   4   5   4   8   3   2   1   1   7   3   4   2
   1   1   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    40    41    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    43    46    40    41    44    45    48  
   38    39    42    40    41    44  
   36    37  
   37  
    0  
   39    42    43    46    47    49    40    41    44  
   42    43    46    40  
   41    44    45    48    51    42  
   44    45    48  
   43    46    47    49    50    52  
   46    47    49  
   45    48    51    55    86    62  
   48    51  
   47    49    50    52    53    54    57  
   49    50    52  
   51    55    56    60    79    86    87    97    62    70    74  
   50    52    53    54    57    58    59    63  
   52    53    54    57  
   55    56    60    61    67    69    79    80    86    87    97   102    88    62    70    71    72    73    74    75    76    77  
   53    54    57    58    59    63    64    65    66  
   54    57    58    59    63  
   57    58    59    63  
   56    60    61    67    68    78   115    69    79    86    87    97    81    62    70    71    72    73    74    75    76    77  
   60    61    67    69    86    62    70    74  
   58    59    63    64    65    66  
   59    63    64    65    66  
   63    64    65    66  
   61    67    68    78    83    95   109   115   116    69    79    80    86    88    81    82    92    62    70    74  
   67    68    78   115    69    79    81    62  
   70    71    72    73    74    75    76    77    67    69    79    86    87    97  
   64    65    66  
   65    66  
   66  
    0  
   68    78    83    84    85    95   115    69    79    81    92    93    94    98  
   78    83    69    92  
   79    80    86    87    97    88    89    90    91    81    82    78    83    95    96   100   104   109   110   115   116  
   71    72    73    74    75    76    77    86  
   72    73    74  
   73    74  
   74  
   75    76    77    86  
   76    77  
   77  
    0  
   83    84    85    95    96   100   115    92    93    94    98    99  
   80    86    87    97   102    88    89    90    91    81    82    95   109   115   116  
   86    87    97    88    89    90    91    81   115  
   82    86    88    95   109   115   116  
  115  
   84    85    95    96   100   101   104   109   115   116    92    93    94    98  
   85    95    96   100   115    92  
   95    96   100   115    92  
   87    97   102   103   105    88    89    90    91   115  
   97   102    88  
   89    90    91    97   115  
   90    91  
   91  
    0  
   93    94    98    99    95  
   94    98    99  
   98    99  
   96   100   101   104   109   110   115   116   111  
  100   101   104   109   115   116  
  102   103   105   106   107   108  
   99  
    0  
  101   104   109   110   115   116   111   112   113   114  
  104   109   115   111  
  103   105   106   107   108  
  105   106   107   108  
  109   110   115   116   111   112   113   114  
  106   107   108  
  107   108  
  108  
    0  
  110   115   116   111   112   113   114  
  115   116   111  
  112   113   114   115  
  113   114  
  114  
    0  
  116  
    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   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   45   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   46   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   47   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   48   2.8500   0.1400  -0.707500   1.7660   1.5600   0.020110767  -0.896042159
   49   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   50   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660   0.206000   1.9750   1.7500   0.005000000  -0.741685710
   52   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   63   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   68   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   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  -0.180000   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   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   82   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   83   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5000   0.0660   0.236500   1.9750   1.7500   0.005000000  -0.741685710
   87   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   88   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   3.5000   0.0660   0.145000   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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   97   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   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   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
  101   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
  102   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
  103   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
  104   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
  105   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  106   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  107   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  108   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  109   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
  110   2.4200   0.0300   0.115000   1.4250   1.2500   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   1.4250   1.2500   0.008598240   0.268726247
  113   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  114   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  115   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
  116   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    46   380.000  1.444
   46    47   340.000  1.080
   46    49   549.000  1.340
   49    50   340.000  1.080
   49    52   317.000  1.510
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    57   268.000  1.529
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    63   268.000  1.529
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   340.000  1.090
   40    41   340.000  1.080
   40    44   465.000  1.376
   44    45   745.000  1.250
   44    48   440.000  1.360
   48    51   320.000  1.410
   51    55   260.000  1.509
   51    86   275.000  1.510
   51    62   260.000  1.509
   55    56   340.000  1.088
   55    60   275.000  1.510
   55    62   260.000  1.509
   60    61   340.000  1.090
   60    67   317.000  1.510
   60    69   268.000  1.529
   67    68   340.000  1.080
   67    78   549.000  1.340
   78    83   317.000  1.510
   78    92   317.000  1.510
   83    84   340.000  1.090
   83    85   340.000  1.090
   83    95   268.000  1.529
   95    96   340.000  1.090
   95   100   317.000  1.522
   95   115   268.000  1.529
  100   101   570.000  1.229
  100   104   320.000  1.462
  104   109   549.000  1.340
  104   111   317.000  1.510
  109   110   340.000  1.080
  109   115   317.000  1.510
  115   116   340.000  1.090
  115    69   268.000  1.529
   69    79   268.000  1.529
   69    81   320.000  1.410
   79    80   340.000  1.090
   79    86   268.000  1.529
   79    88   268.000  1.529
   86    87   340.000  1.090
   86    97   320.000  1.410
   97   102   214.000  1.327
  102   103   570.000  1.229
  102   105   317.000  1.522
  105   106   340.000  1.090
  105   107   340.000  1.090
  105   108   340.000  1.090
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    91   340.000  1.090
   81    82   553.000  0.945
  111   112   340.000  1.090
  111   113   340.000  1.090
  111   114   340.000  1.090
   92    93   340.000  1.090
   92    94   340.000  1.090
   92    98   320.000  1.410
   98    99   553.000  0.945
   62    70   275.000  1.510
   62    74   275.000  1.510
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   340.000  1.090
   74    75   340.000  1.090
   74    76   340.000  1.090
   74    77   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    41    35.00000  117.00000
   33    40    44    70.00000  124.00000
   38    33    34    35.00000  109.50000
   38    42    43    35.00000  120.00000
   38    42    46    70.00000  123.01800
   42    38    39    35.00000  120.00000
   42    46    47    35.00000  120.00000
   42    46    49    70.00000  123.01800
   46    42    43    35.00000  120.00000
   46    49    50    35.00000  120.00000
   46    49    52    70.00000  124.00000
   49    46    47    35.00000  120.00000
   49    52    53    35.00000  109.50000
   49    52    54    35.00000  109.50000
   49    52    57    70.00000  112.02700
   52    49    50    35.00000  117.00000
   52    57    58    37.50000  110.70000
   52    57    59    37.50000  110.70000
   52    57    63    58.35000  112.70000
   54    52    53    33.00000  107.80000
   57    52    53    37.50000  110.70000
   57    52    54    37.50000  110.70000
   57    63    64    37.50000  110.70000
   57    63    65    37.50000  110.70000
   57    63    66    37.50000  110.70000
   59    57    58    33.00000  107.80000
   63    57    58    37.50000  110.70000
   63    57    59    37.50000  110.70000
   65    63    64    33.00000  107.80000
   66    63    64    33.00000  107.80000
   66    63    65    33.00000  107.80000
   40    33    34    35.00000  109.50000
   40    33    38    70.00000  110.12100
   40    44    45    65.00000  137.10300
   40    44    48    80.00000  120.01400
   44    40    41    40.00000  120.50800
   44    48    51    90.00000  111.18400
   48    44    45    65.00000  121.00000
   48    51    55    50.00000  109.50000
   48    51    86    50.00000  109.50000
   48    51    62    50.00000  109.50000
   51    55    56    37.50000  117.20000
   51    55    60    60.00000  120.94000
   51    55    62    10.00000   60.00500
   51    86    79    70.00000  112.37300
   51    86    87    45.00000  109.38400
   51    86    97    50.00000  109.50000
   51    62    55    10.00000   60.00500
   51    62    70    60.00000  120.94000
   51    62    74    60.00000  120.94000
   55    60    61    45.00000  109.38400
   55    60    67    70.00000  112.02700
   55    60    69    70.00000  112.37300
   55    62    70    60.00000  120.94000
   55    62    74    60.00000  120.94000
   60    55    56    40.00000  115.04500
   60    67    68    35.00000  117.00000
   60    67    78    70.00000  124.00000
   60    69   115    58.35000  112.70000
   60    69    79    58.35000  112.70000
   60    69    81    50.00000  109.50000
   67    60    61    35.00000  109.50000
   67    78    83    70.00000  124.00000
   67    78    92    70.00000  124.00000
   78    67    68    35.00000  120.00000
   78    83    84    35.00000  109.50000
   78    83    85    35.00000  109.50000
   78    83    95    70.00000  112.02700
   78    92    93    35.00000  109.50000
   78    92    94    35.00000  109.50000
   78    92    98    90.00000  110.39200
   83    95    96    37.50000  110.70000
   83    95   100    63.00000  111.10000
   83    95   115    58.35000  112.70000
   85    83    84    33.00000  107.80000
   95    83    84    37.50000  110.70000
   95    83    85    37.50000  110.70000
   95   100   101    80.00000  120.40000
   95   100   104    65.00000  118.62400
   95   115   109    70.00000  112.02700
   95   115   116    37.50000  110.70000
   95   115    69    58.35000  112.70000
  100    95    96    35.00000  109.50000
  100   104   109    65.00000  118.96000
  100   104   111    65.00000  116.34900
  104   100   101    80.00000  123.72100
  104   109   110    35.00000  120.00000
  104   109   115    70.00000  124.00000
  104   111   112    35.00000  109.50000
  104   111   113    35.00000  109.50000
  104   111   114    35.00000  109.50000
  109   115   116    35.00000  109.50000
  109   115    69    70.00000  112.02700
  115    95    96    37.50000  110.70000
  115    95   100    63.00000  111.10000
  115   109   110    35.00000  117.00000
  115    69    79    58.35000  112.70000
  115    69    81    50.00000  109.50000
   69    60    61    37.50000  110.70000
   69    60    67    70.00000  112.02700
   69   115   116    37.50000  110.70000
   69    79    80    37.50000  110.70000
   69    79    86    58.35000  112.70000
   69    79    88    58.35000  112.70000
   69    81    82    55.00000  108.50000
   79    86    87    37.50000  110.70000
   79    86    97    50.00000  109.50000
   79    88    89    37.50000  110.70000
   79    88    90    37.50000  110.70000
   79    88    91    37.50000  110.70000
   86    51    55    60.00000  120.94000
   86    79    80    37.50000  110.70000
   86    97   102    83.00000  116.90000
   97    86    87    35.00000  109.50000
   97   102   103    83.00000  123.40000
   97   102   105    81.00000  111.40000
  102   105   106    35.00000  109.50000
  102   105   107    35.00000  109.50000
  102   105   108    35.00000  109.50000
  105   102   103    80.00000  120.40000
  107   105   106    33.00000  107.80000
  108   105   106    33.00000  107.80000
  108   105   107    33.00000  107.80000
   88    79    80    37.50000  110.70000
   88    79    86    58.35000  112.70000
   90    88    89    33.00000  107.80000
   91    88    89    33.00000  107.80000
   91    88    90    33.00000  107.80000
   81    69    79    50.00000  109.50000
  111   104   109    70.00000  124.00000
  113   111   112    33.00000  107.80000
  114   111   112    33.00000  107.80000
  114   111   113    33.00000  107.80000
   92    78    83    65.00000  117.92700
   92    98    99    55.00000  108.50000
   94    92    93    33.00000  107.80000
   98    92    93    35.00000  109.50000
   98    92    94    35.00000  109.50000
   62    51    55    10.00000   60.00500
   62    51    86    60.00000  120.94000
   62    55    56    37.50000  117.20000
   62    55    60    60.00000  120.94000
   62    70    71    45.00000  109.38400
   62    70    72    45.00000  109.38400
   62    70    73    45.00000  109.38400
   62    74    75    45.00000  109.38400
   62    74    76    45.00000  109.38400
   62    74    77    45.00000  109.38400
   72    70    71    33.00000  107.80000
   73    70    71    33.00000  107.80000
   73    70    72    33.00000  107.80000
   74    62    70    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
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
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  100   104   111   114   0.15000  1.0 3.0
  101   100   104   109   1.00000 -1.0 2.0
  101   100   104   111  -0.64400  1.0 1.0
  101   100   104   111   0.26850 -1.0 2.0
  104   109  -115    95   0.09850  1.0 1.0
  104   109  -115    95   0.15250 -1.0 2.0
  104   109  -115    95  -0.50650  1.0 3.0
  104   109   115   116   0.00000  1.0 1.0
  104   109   115    69   0.09850  1.0 1.0
  104   109   115    69   0.15250 -1.0 2.0
  104   109   115    69  -0.50650  1.0 3.0
  109   104   111   112   0.00000  1.0 1.0
  109   104   111   113   0.00000  1.0 1.0
  109   104   111   114   0.00000  1.0 1.0
  109   115    69    60   0.34400  1.0 1.0
  109   115    69    60   0.09450 -1.0 2.0
  109   115    69    60   0.11100  1.0 3.0
  109   115    69    79   0.34400  1.0 1.0
  109   115    69    79   0.09450 -1.0 2.0
  109   115    69    79   0.11100  1.0 3.0
  109   115    69    81   1.05650  1.0 1.0
  109   115    69    81   0.15600 -1.0 2.0
  109   115    69    81   0.53150  1.0 3.0
  110   109   115    95   0.00000  1.0 1.0
  110   109   115   116   0.33100  1.0 3.0
  110   109   115    69   0.00000  1.0 1.0
  115    95   100   101   0.30150 -1.0 2.0
  115    95  -100   104   0.65300  1.0 1.0
  115    95  -100   104  -0.03850 -1.0 2.0
  115    95  -100   104   0.33900  1.0 3.0
  115    69    79    80   0.15000  1.0 3.0
  115    69    79    86   0.56750  1.0 1.0
  115    69    79    86  -0.07550 -1.0 2.0
  115    69    79    86   0.20000  1.0 3.0
  115    69    79    88   0.56750  1.0 1.0
  115    69    79    88  -0.07550 -1.0 2.0
  115    69    79    88   0.20000  1.0 3.0
  115    69    81    82  -0.11600  1.0 1.0
  115    69    81    82  -0.09450 -1.0 2.0
  115    69    81    82   0.21250  1.0 3.0
  116   115    69    60   0.15000  1.0 3.0
  116   115    69    79   0.15000  1.0 3.0
  116   115    69    81   0.23400  1.0 3.0
   69    60    67    68   0.00000  1.0 1.0
   69    60    67    78   0.09850  1.0 1.0
   69    60    67    78   0.15250 -1.0 2.0
   69    60    67    78  -0.50650  1.0 3.0
   69    79   -86    51   0.47050  1.0 1.0
   69    79   -86    51   0.03900 -1.0 2.0
   69    79   -86    51   0.20100  1.0 3.0
   69    79    86    87   0.15000  1.0 3.0
   69    79    86    97   0.62750  1.0 1.0
   69    79    86    97  -0.30950 -1.0 2.0
   69    79    86    97   0.27300  1.0 3.0
   69    79    88    89   0.15000  1.0 3.0
   69    79    88    90   0.15000  1.0 3.0
   69    79    88    91   0.15000  1.0 3.0
   79    69    81    82  -0.11600  1.0 1.0
   79    69    81    82  -0.09450 -1.0 2.0
   79    69    81    82   0.21250  1.0 3.0
   79    86    97   102  -0.25900  1.0 1.0
   79    86    97   102  -0.47000 -1.0 2.0
   79    86    97   102   0.11750  1.0 3.0
   80    79    86    51   0.15000  1.0 3.0
   80    79    86    87   0.15000  1.0 3.0
   80    79    86    97   0.23400  1.0 3.0
   80    79    88    89   0.15000  1.0 3.0
   80    79    88    90   0.15000  1.0 3.0
   80    79    88    91   0.15000  1.0 3.0
   86    51    55    56   0.15000  1.0 3.0
   86    51   -55    60   0.56750  1.0 1.0
   86    51   -55    60  -0.07550 -1.0 2.0
   86    51   -55    60   0.20000  1.0 3.0
   86    51   -55    62   0.07850  1.0 1.0
   86    51   -55    62  -0.03950 -1.0 2.0
   86    51   -55    62   0.67350  1.0 3.0
   86    51   -62    55   0.07850  1.0 1.0
   86    51   -62    55  -0.03950 -1.0 2.0
   86    51   -62    55   0.67350  1.0 3.0
   86    51    62    70   0.56750  1.0 1.0
   86    51    62    70  -0.07550 -1.0 2.0
   86    51    62    70   0.20000  1.0 3.0
   86    51    62    74   0.56750  1.0 1.0
   86    51    62    74  -0.07550 -1.0 2.0
   86    51    62    74   0.20000  1.0 3.0
   86    79    88    89   0.15000  1.0 3.0
   86    79    88    90   0.15000  1.0 3.0
   86    79    88    91   0.15000  1.0 3.0
   86    97   102   103   3.00000 -1.0 2.0
   86    97   102   105   1.63150  1.0 1.0
   86    97   102   105   2.92000 -1.0 2.0
   87    86    97   102   0.08050  1.0 3.0
   97   102   105   106   0.00000  1.0 1.0
   97   102   105   107   0.00000  1.0 1.0
   97   102   105   108   0.00000  1.0 1.0
  103   102   105   106   0.00000  1.0 1.0
  103   102   105   107   0.00000  1.0 1.0
  103   102   105   108   0.00000  1.0 1.0
   88    79    86    51   0.47050  1.0 1.0
   88    79    86    51   0.03900 -1.0 2.0
   88    79    86    51   0.20100  1.0 3.0
   88    79    86    87   0.15000  1.0 3.0
   88    79    86    97   0.62750  1.0 1.0
   88    79    86    97  -0.30950 -1.0 2.0
   88    79    86    97   0.27300  1.0 3.0
   81    69    79    80   0.23400  1.0 3.0
   81    69    79    86   0.86500  1.0 1.0
   81    69    79    86  -0.17500 -1.0 2.0
   81    69    79    86   0.20800  1.0 3.0
   81    69    79    88   0.86500  1.0 1.0
   81    69    79    88  -0.17500 -1.0 2.0
   81    69    79    88   0.20800  1.0 3.0
  111   104   109   110   7.00000 -1.0 2.0
  111   104   109   115   7.00000 -1.0 2.0
   92    78    83    84   0.34800  1.0 3.0
   92    78    83    85   0.34800  1.0 3.0
   92    78    83    95   0.46850  1.0 1.0
   92    78    83    95   0.08550 -1.0 2.0
   92    78    83    95   0.09800  1.0 3.0
   93    92    98    99   0.19450  1.0 3.0
   94    92    98    99   0.19450  1.0 3.0
   62    51   -55    56   0.15000  1.0 3.0
   62    51   -55    60   0.07850  1.0 1.0
   62    51   -55    60  -0.03950 -1.0 2.0
   62    51   -55    60   0.67350  1.0 3.0
   62    51    86    79   0.07850  1.0 1.0
   62    51    86    79  -0.03950 -1.0 2.0
   62    51    86    79   0.67350  1.0 3.0
   62    51    86    87   0.15000  1.0 3.0
   62    51    86    97  -0.26800  1.0 1.0
   62    51    86    97   0.69150 -1.0 2.0
   62    51    86    97  -0.48750  1.0 3.0
   62    55    60    61   0.15000  1.0 3.0
   62    55    60    67   0.34400  1.0 1.0
   62    55    60    67   0.09450 -1.0 2.0
   62    55    60    67   0.11100  1.0 3.0
   62    55    60    69   0.07850  1.0 1.0
   62    55    60    69  -0.03950 -1.0 2.0
   62    55    60    69   0.67350  1.0 3.0
   70    62    74    75   0.15000  1.0 3.0
   70    62    74    76   0.15000  1.0 3.0
   70    62    74    77   0.15000  1.0 3.0
   74    62    70    71   0.15000  1.0 3.0
   74    62    70    72   0.15000  1.0 3.0
   74    62    70    73   0.15000  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  15.00000 -1.0 2.0
   46    43    42    38  15.00000 -1.0 2.0
   42    47    46    49  15.00000 -1.0 2.0
   52    50    49    46  15.00000 -1.0 2.0
   33    41    40    44  15.00000 -1.0 2.0
   45    48    44    40  15.00000 -1.0 2.0
   60    68    67    78   1.10000 -1.0 2.0
   83    92    78    67   1.10000 -1.0 2.0
   95   104   100   101  10.50000 -1.0 2.0
  100   111   104   109   1.10000 -1.0 2.0
  115   110   109   104   1.10000 -1.0 2.0
   97   105   102   103  10.50000 -1.0 2.0
END
