* LIGAND DATABASE FILE (OPLS2005)
*
001     114   115    214    323     629
    1     0 S   NP   _N1_     1    28.72150    92.85038   -23.85089
    2     1 S   H    _HN1     2     1.02936    91.61271    14.49288
    3     1 S   H    _H1_     3     1.02825    17.11374   169.54338
    4     1 S   H    _H2_     4     1.02783   107.14108   -95.25528
    5     1 S   CT   _CA1     5     1.50073   124.64613   130.79090
    6     5 S   HC   _HA1     6     1.09561   105.24854    70.40601
    7     5 S   CO3  _C1_     7     1.53810   112.30429   -50.00162
    8     7 S   O2Z  _O11     8     1.26382   115.00375   -44.35720
    9     7 S   O2Z  _O12     9     1.26235   114.93867   134.74658
   10     5 S   CT   _CB1    10     1.53049   107.52240  -171.44898
   11    10 S   HC   HB11    11     1.09809   109.61378   -48.34476
   12    10 S   HC   HB12    12     1.09792   110.35461    68.40550
   13    10 S   CT   _CG1    13     1.52961   112.60268  -169.12840
   14    13 S   HC   HG11    14     1.09581   110.65097   -61.29555
   15    13 S   HC   HG12    15     1.09648   109.87531    58.00420
   16    13 S   C    _CD1    16     1.51749   112.09245   178.67647
   17    16 S   O    _OE1    17     1.22745   123.22475     5.18142
   18    16 S   N    _N2_    18     1.38672   111.70253  -175.42252
   19    18 S   H    _HN2    19     1.01574   119.14906     3.45003
   20    18 S   CT1  _CA2    20     1.46237   123.25979  -178.03457
   21    20 S   HC   _HA2    21     1.09748   109.11214     2.93752
   22    20 S   C    _C2_    22     1.53456   109.29438  -112.78340
   23    22 S   O    _O2_    23     1.23066   122.18956  -150.88222
   24    20 S   CT   _CB2    32     1.53563   111.57195   124.28819
   25    24 S   HC   HB21    33     1.09498   109.78214    61.46597
   26    24 S   HC   HB22    34     1.09433   109.69070  -179.75772
   27    22 S   N    _N3_    24     1.38309   113.79665    36.65653
   28    27 S   H    _HN3    25     1.01585   119.53837    -3.59755
   29    24 S   S    _SG2    35     1.83112   110.79003   -59.15811
   30    27 S   CT   _CA3    26     1.45279   123.18669   176.99593
   31    30 S   HC   HA31    27     1.09551   107.52180   -64.11435
   32    30 S   HC   HA32    28     1.09558   107.96480    52.30989
   33    29 S   CT   _C14    36     1.87650   101.47205  -174.48136
   34    30 S   CO3  _C3_    29     1.52950   114.10751   174.29422
   35    34 S   O2Z  _O31    30     1.26372   116.07416    -0.82234
   36    34 S   O2Z  _O32    31     1.26430   114.41086   179.24593
   37    33 S   CO4  _C13    37     1.52842   105.23751    66.18446
   38    37 S   O    _O33    38     1.23088   122.71700    47.11196
   39    33 S   CM   _C5_    51     1.52918   110.05880   -58.23365
   40    33 S   CT   _C15    56     1.55751   105.94709   179.23741
   41    40 S   HC   _H12    57     1.09757   110.87947    58.82330
   42    40 S   HC   _H13    58     1.09693   109.54186   -56.29791
   43    37 S   CA   _C12    39     1.46991   118.18185  -135.47415
   44    39 S   CT   _C4_    52     1.53238   115.05541   -54.65748
   45    44 S   HC   _H5_    53     1.09322   111.21113   -48.63148
   46    44 S   HC   _H6_    54     1.09459   113.52084  -167.33768
   47    44 S   HC   _H7_    55     1.09404   111.02863    72.50632
   48    40 S   CM   _C16    59     1.51184   114.35713   179.72375
   49    48 S   HC   _H14    60     1.08922   114.82933   -64.45426
   50    43 S   CA   _C11    40     1.40770   117.90098  -169.42422
   51    50 S   HA   _H11    41     1.08737   121.07677    -0.24629
   52    48 S   CM   _C17    61     1.34776   127.01600   117.84066
   53    50 S   CA   _C10    42     1.39008   120.52809   179.38738
   54    53 S   HA   _H10    43     1.08561   120.28943  -179.87028
   55    52 S   CT   _C18    62     1.50469   120.59271   178.17479
   56    55 S   HC   _H15    63     1.09492   110.24553   118.70694
   57    55 S   HC   _H16    64     1.09510   112.35919    -1.32530
   58    55 S   HC   _H17    65     1.09481   110.28960  -121.39702
   59    52 S   CT   _C19    66     1.51165   124.11027    -2.11470
   60    59 S   HC   _H18    67     1.09749   109.68782  -153.69844
   61    59 S   HC   _H19    68     1.09603   110.08153   -38.53879
   62    53 S   CA   _C9_    44     1.38582   119.35874    -0.00000
   63    62 S   HA   _H9_    45     1.08609   120.21673  -179.89347
   64    59 S   CT   _C20    69     1.53280   111.92093    84.24136
   65    64 S   HC   _H20    70     1.09624   109.48593    61.76463
   66    64 S   HC   _H21    71     1.09486   109.34251   -55.14568
   67    62 S   CA   _C8_    46     1.39855   119.88950     0.13988
   68    67 S   HA   _H8_    47     1.08882   116.75558  -179.93744
   69    64 S   CT   _C21    72     1.53208   111.04096  -176.70741
   70    69 S   HC   _H22    73     1.09803   108.65019   -64.69550
   71    69 S   HC   _H23    74     1.09668   109.46101    50.07686
   72    43 S   CA   _C7_    48     1.39866   120.46242    10.23024
   73    69 S   CT   _C22    75     1.54292   115.04434   173.14299
   74    73 S   HC   _H3_    76     1.09876   106.55495  -178.75243
   75    72 S   CMA  _C6_    49     1.51642   123.66516     1.08191
   76    75 S   OM   _O34    50     1.26982   118.63623   173.04822
   77    73 S   CT   _C23    77     1.53201   111.31233    65.10263
   78    77 S   HC   _H24    78     1.09468   111.73433   -68.37271
   79    77 S   HC   _H25    79     1.09544   110.55343   171.77870
   80    77 S   HC   _H26    80     1.09501   110.90964    52.49346
   81    73 S   CT   _C24    81     1.54382   114.66756   -60.17726
   82    81 S   HC   _H27    82     1.09806   108.22262  -176.83653
   83    81 S   HC   _H28    83     1.09662   110.41085    67.49830
   84    81 S   CT   _C25    84     1.53332   113.71153   -55.99441
   85    84 S   HC   _H29    85     1.09632   109.43519   -53.02460
   86    84 S   HC   _H30    86     1.09410   109.35639    64.67642
   87    84 S   CT   _C26    87     1.53403   111.37995  -174.32992
   88    87 S   HC   _H31    88     1.09759   108.38545    52.02075
   89    87 S   HC   _H32    89     1.09746   109.44645   -63.94793
   90    87 S   CT   _C27    90     1.54553   113.57548   172.91086
   91    90 S   HC   _H4_    91     1.09776   108.06625   -54.16495
   92    90 S   CT   _C28    92     1.53130   111.62346    64.76793
   93    92 S   HC   _H33    93     1.09466   110.85630    62.46733
   94    92 S   HC   _H34    94     1.09374   111.46940  -177.11636
   95    92 S   HC   _H35    95     1.09371   111.65085   -58.29897
   96    90 S   CT   _C29    96     1.54531   109.28467  -171.76346
   97    96 S   HC   _H36    97     1.09759   108.82377    48.91291
   98    96 S   HC   _H37    98     1.09754   109.85663   -67.51434
   99    96 S   CT   _C30    99     1.53364   113.43535   169.50742
  100    99 S   HC   _H38   100     1.09406   109.72743    63.61556
  101    99 S   HC   _H39   101     1.09638   109.38353   -54.19711
  102    99 S   CT   _C31   102     1.53268   111.25849  -175.39461
  103   102 S   HC   _H40   103     1.09708   109.25277   -65.26131
  104   102 S   HC   _H41   104     1.09766   108.85763    50.73677
  105   102 S   CT   _C32   105     1.54022   113.47659   171.64906
  106   105 S   HC   _H42   106     1.09748   108.51518   -58.29366
  107   105 S   CT   _C33   107     1.52872   112.79788    61.41765
  108   107 S   HC   _H43   108     1.09383   111.24488    57.30572
  109   107 S   HC   _H44   109     1.09545   110.70115   177.20306
  110   107 S   HC   _H45   110     1.09405   111.47827   -63.62610
  111   105 S   CT   _C34   111     1.53065   109.80002  -175.85272
  112   111 S   HC   _H46   112     1.09526   111.30640   -62.23112
  113   111 S   HC   _H47   113     1.09515   110.83549    58.04553
  114   111 S   HC   _H48   114     1.09519   110.83150   177.52472
  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  11   5   4   3
  18   2   1   1  14   5  13  10   4   3  10   6   3   2   1  10
   3   8   4  11   6   3   7   3   2   1   9   5   4   5   3   9
   5   4   4   2  12   5   4   2  12   8   1   1   7   3   2   1
   9   5   4   9   5   4  12   5   4  12   8   7   3   2   1   9
   5   4   9   5   4  12   5   4   9   8   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    39    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    43    75    39    44    40    41    42    48  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    43    50    72    75    76    39    44    45    46    47    40    41    42    48    49    52  
   35    36  
   36  
    0  
   38    43    50    51    53    67    72    75    39    44    40    41    42    48  
   43    50    72    39    40  
   44    45    46    47    40    41    42    48    43    67    72    75    76  
   41    42    48    49    52    55    59    43    44    75  
   42    48    49    52  
   48    49    52  
   50    51    53    54    62    67    68    72    75    76  
   45    46    47    72    75    76  
   46    47    75  
   47    75  
   75  
   49    52    55    56    57    58    59    60    61    64  
   52    55    59  
   51    53    54    62    63    67    72    75  
   53    54    62    72  
   55    56    57    58    59    60    61    64    65    66    69  
   54    62    63    67    68    72  
   62    63    67  
   56    57    58    59    60    61    64  
   57    58    59  
   58    59  
   59  
   60    61    64    65    66    69    70    71    73  
   61    64    65    66    69  
   64    65    66    69  
   63    67    68    72    75  
   67    68    72  
   65    66    69    70    71    73    74    77    81  
   66    69    70    71    73  
   69    70    71    73  
   68    72    75    76  
   72    75  
   70    71    73    74    77    78    79    80    81    82    83    84  
   71    73    74    77    81  
   73    74    77    81  
   75    76  
   74    77    78    79    80    81    82    83    84    85    86    87  
   77    78    79    80    81    82    83    84  
   76  
    0  
   78    79    80    81    82    83    84  
   79    80    81  
   80    81  
   81  
   82    83    84    85    86    87    88    89    90  
   83    84    85    86    87  
   84    85    86    87  
   85    86    87    88    89    90    91    92    96  
   86    87    88    89    90  
   87    88    89    90  
   88    89    90    91    92    93    94    95    96    97    98    99  
   89    90    91    92    96  
   90    91    92    96  
   91    92    93    94    95    96    97    98    99   100   101   102  
   92    93    94    95    96    97    98    99  
   93    94    95    96    97    98    99  
   94    95    96  
   95    96  
   96  
   97    98    99   100   101   102   103   104   105  
   98    99   100   101   102  
   99   100   101   102  
  100   101   102   103   104   105   106   107   111  
  101   102   103   104   105  
  102   103   104   105  
  103   104   105   106   107   108   109   110   111   112   113   114  
  104   105   106   107   111  
  105   106   107   111  
  106   107   108   109   110   111   112   113   114  
  107   108   109   110   111   112   113   114  
  108   109   110   111   112   113   114  
  109   110   111  
  110   111  
  111  
  112   113   114  
  113   114  
  114  
    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   0.167500   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   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   39   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   49   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   51   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   52   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   53   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   54   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   55   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   64   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   68   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   69   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   73   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   76   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   77   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  100   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  108   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   2.5000   0.0300   0.060000   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
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  1.522
   33    39   317.000  1.510
   33    40   268.000  1.529
   37    38   570.000  1.229
   37    43   310.000  1.470
   43    50   469.000  1.400
   43    72   469.000  1.400
   50    51   367.000  1.080
   50    53   469.000  1.400
   53    54   367.000  1.080
   53    62   469.000  1.400
   62    63   367.000  1.080
   62    67   469.000  1.400
   67    68   367.000  1.080
   67    72   469.000  1.400
   72    75   320.000  1.460
   75    76   745.000  1.250
   75    39   465.000  1.376
   39    44   317.000  1.510
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   340.000  1.090
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    48   317.000  1.510
   48    49   340.000  1.080
   48    52   549.000  1.340
   52    55   317.000  1.510
   52    59   317.000  1.510
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    64   268.000  1.529
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    69   268.000  1.529
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    73   268.000  1.529
   73    74   340.000  1.090
   73    77   268.000  1.529
   73    81   268.000  1.529
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    80   340.000  1.090
   81    82   340.000  1.090
   81    83   340.000  1.090
   81    84   268.000  1.529
   84    85   340.000  1.090
   84    86   340.000  1.090
   84    87   268.000  1.529
   87    88   340.000  1.090
   87    89   340.000  1.090
   87    90   268.000  1.529
   90    91   340.000  1.090
   90    92   268.000  1.529
   90    96   268.000  1.529
   92    93   340.000  1.090
   92    94   340.000  1.090
   92    95   340.000  1.090
   96    97   340.000  1.090
   96    98   340.000  1.090
   96    99   268.000  1.529
   99   100   340.000  1.090
   99   101   340.000  1.090
   99   102   268.000  1.529
  102   103   340.000  1.090
  102   104   340.000  1.090
  102   105   268.000  1.529
  105   106   340.000  1.090
  105   107   268.000  1.529
  105   111   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
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  110.18000
   29    33    39    75.00000  112.20000
   29    33    40    75.00000  111.63000
   33    37    38    80.00000  120.40000
   33    37    43    65.00000  115.47100
   33    39    75    70.00000  124.00000
   33    39    44    65.00000  117.92700
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    48    70.00000  112.02700
   37    43    50    60.00000  119.52600
   37    43    72    60.00000  119.52600
   43    37    38    75.00000  123.78400
   43    50    51    35.00000  120.00000
   43    50    53    63.00000  120.00000
   43    72    67    63.00000  120.00000
   43    72    75    60.00000  120.93500
   50    53    54    35.00000  120.00000
   50    53    62    63.00000  120.00000
   53    50    51    35.00000  120.00000
   53    62    63    35.00000  120.00000
   53    62    67    63.00000  120.00000
   62    53    54    35.00000  120.00000
   62    67    68    35.00000  120.00000
   62    67    72    63.00000  120.00000
   67    62    63    35.00000  120.00000
   67    72    75    60.00000  120.93500
   72    43    50    63.00000  120.00000
   72    67    68    35.00000  120.00000
   72    75    76    85.00000  114.86500
   72    75    39    60.00000  123.20500
   75    39    44    70.00000  124.00000
   39    33    37    70.00000  109.06800
   39    75    76    65.00000  137.10300
   39    44    45    35.00000  109.50000
   39    44    46    35.00000  109.50000
   39    44    47    35.00000  109.50000
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    33.00000  107.80000
   40    33    37    63.00000  111.10000
   40    33    39    70.00000  112.02700
   40    48    49    35.00000  117.00000
   40    48    52    70.00000  124.00000
   42    40    41    33.00000  107.80000
   48    40    41    35.00000  109.50000
   48    40    42    35.00000  109.50000
   48    52    55    70.00000  124.00000
   48    52    59    70.00000  124.00000
   52    48    49    35.00000  120.00000
   52    55    56    35.00000  109.50000
   52    55    57    35.00000  109.50000
   52    55    58    35.00000  109.50000
   52    59    60    35.00000  109.50000
   52    59    61    35.00000  109.50000
   52    59    64    70.00000  112.02700
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   59    52    55    65.00000  117.92700
   59    64    65    37.50000  110.70000
   59    64    66    37.50000  110.70000
   59    64    69    58.35000  112.70000
   61    59    60    33.00000  107.80000
   64    59    60    37.50000  110.70000
   64    59    61    37.50000  110.70000
   64    69    70    37.50000  110.70000
   64    69    71    37.50000  110.70000
   64    69    73    58.35000  112.70000
   66    64    65    33.00000  107.80000
   69    64    65    37.50000  110.70000
   69    64    66    37.50000  110.70000
   69    73    74    37.50000  110.70000
   69    73    77    58.35000  112.70000
   69    73    81    58.35000  112.70000
   71    69    70    33.00000  107.80000
   73    69    70    37.50000  110.70000
   73    69    71    37.50000  110.70000
   73    77    78    37.50000  110.70000
   73    77    79    37.50000  110.70000
   73    77    80    37.50000  110.70000
   73    81    82    37.50000  110.70000
   73    81    83    37.50000  110.70000
   73    81    84    58.35000  112.70000
   77    73    74    37.50000  110.70000
   79    77    78    33.00000  107.80000
   80    77    78    33.00000  107.80000
   80    77    79    33.00000  107.80000
   81    73    74    37.50000  110.70000
   81    73    77    58.35000  112.70000
   81    84    85    37.50000  110.70000
   81    84    86    37.50000  110.70000
   81    84    87    58.35000  112.70000
   83    81    82    33.00000  107.80000
   84    81    82    37.50000  110.70000
   84    81    83    37.50000  110.70000
   84    87    88    37.50000  110.70000
   84    87    89    37.50000  110.70000
   84    87    90    58.35000  112.70000
   86    84    85    33.00000  107.80000
   87    84    85    37.50000  110.70000
   87    84    86    37.50000  110.70000
   87    90    91    37.50000  110.70000
   87    90    92    58.35000  112.70000
   87    90    96    58.35000  112.70000
   89    87    88    33.00000  107.80000
   90    87    88    37.50000  110.70000
   90    87    89    37.50000  110.70000
   90    92    93    37.50000  110.70000
   90    92    94    37.50000  110.70000
   90    92    95    37.50000  110.70000
   90    96    97    37.50000  110.70000
   90    96    98    37.50000  110.70000
   90    96    99    58.35000  112.70000
   92    90    91    37.50000  110.70000
   94    92    93    33.00000  107.80000
   95    92    93    33.00000  107.80000
   95    92    94    33.00000  107.80000
   96    90    91    37.50000  110.70000
   96    90    92    58.35000  112.70000
   96    99   100    37.50000  110.70000
   96    99   101    37.50000  110.70000
   96    99   102    58.35000  112.70000
   98    96    97    33.00000  107.80000
   99    96    97    37.50000  110.70000
   99    96    98    37.50000  110.70000
   99   102   103    37.50000  110.70000
   99   102   104    37.50000  110.70000
   99   102   105    58.35000  112.70000
  101    99   100    33.00000  107.80000
  102    99   100    37.50000  110.70000
  102    99   101    37.50000  110.70000
  102   105   106    37.50000  110.70000
  102   105   107    58.35000  112.70000
  102   105   111    58.35000  112.70000
  104   102   103    33.00000  107.80000
  105   102   103    37.50000  110.70000
  105   102   104    37.50000  110.70000
  105   107   108    37.50000  110.70000
  105   107   109    37.50000  110.70000
  105   107   110    37.50000  110.70000
  105   111   112    37.50000  110.70000
  105   111   113    37.50000  110.70000
  105   111   114    37.50000  110.70000
  107   105   106    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   105   106    37.50000  110.70000
  111   105   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
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
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
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  107   105   111   113   0.15000  1.0 3.0
  107   105   111   114   0.15000  1.0 3.0
  111   105   107   108   0.15000  1.0 3.0
  111   105   107   109   0.15000  1.0 3.0
  111   105   107   110   0.15000  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
   35    30    34    36  10.50000 -1.0 2.0
   33    43    37    38  10.50000 -1.0 2.0
   50    72    43    37   4.00000 -1.0 2.0
   53    51    50    43   1.10000 -1.0 2.0
   62    54    53    50   1.10000 -1.0 2.0
   67    63    62    53   1.10000 -1.0 2.0
   72    68    67    62   1.10000 -1.0 2.0
   67    75    72    43   4.00000 -1.0 2.0
   72    76    75    39   1.10000 -1.0 2.0
   33    44    39    75   1.10000 -1.0 2.0
   40    49    48    52  15.00000 -1.0 2.0
   55    59    52    48  15.00000 -1.0 2.0
END
