* LIGAND DATABASE FILE (OPLS2005)
*
001     111   112    207    310     611
    1     0 S   NP   _N1_     1    28.83673    95.62077   -24.94307
    2     1 S   H    _HN1     2     1.02827    34.38264  -179.77100
    3     1 S   H    _H1_     3     1.02791   114.16860   -93.18345
    4     1 S   H    _H2_     4     1.02947    73.14443     9.83019
    5     1 S   CT   _CA1     5     1.50124   129.18976   112.72594
    6     5 S   HC   _HA1     6     1.09574   105.16731    93.11561
    7     5 S   CO3  _C1_     7     1.53778   112.50383   -27.07886
    8     7 S   O2Z  _O11     8     1.26374   115.00398   -41.51961
    9     7 S   O2Z  _O12     9     1.26242   114.94866   137.56519
   10     5 S   CT   _CB1    10     1.53073   107.41611  -148.90754
   11    10 S   HC   HB11    11     1.09837   109.32928   -49.52018
   12    10 S   HC   HB12    12     1.09811   110.46404    67.08184
   13    10 S   CT   _CG1    13     1.53004   112.63156  -170.48188
   14    13 S   HC   HG11    14     1.09575   110.67624   -66.93869
   15    13 S   HC   HG12    15     1.09673   109.73231    52.29477
   16    13 S   C    _CD1    16     1.51810   112.14599   172.74753
   17    16 S   O    _OE1    17     1.22739   123.23864     9.61728
   18    16 S   N    _N2_    18     1.38650   111.71800  -170.32512
   19    18 S   H    _HN2    19     1.01568   118.95174     1.46634
   20    18 S   CT1  _CA2    20     1.46221   123.43972   177.04157
   21    20 S   HC   _HA2    21     1.09737   109.30593     6.97932
   22    20 S   C    _C2_    22     1.53656   108.91967  -108.55887
   23    22 S   O    _O2_    23     1.23076   122.24236  -149.29989
   24    20 S   CT   _CB2    32     1.53279   111.48389   128.98923
   25    24 S   HC   HB21    33     1.09493   109.96623    55.81706
   26    24 S   HC   HB22    34     1.09518   110.15796   174.83768
   27    22 S   N    _N3_    24     1.38316   113.87329    38.23792
   28    27 S   H    _HN3    25     1.01547   119.61690    -3.22531
   29    24 S   S    _SG2    35     1.82811   111.50313   -65.45178
   30    27 S   CT   _CA3    26     1.45287   123.26109   177.16075
   31    30 S   HC   HA31    27     1.09548   107.51790   -64.45189
   32    30 S   HC   HA32    28     1.09555   107.98503    51.99870
   33    29 S   CT   _C13    36     1.86799    99.34955  -178.50184
   34    33 S   HC   _H4_    37     1.09442   104.50450    36.44698
   35    30 S   CO3  _C3_    29     1.52971   114.05089   173.98275
   36    35 S   O2Z  _O31    30     1.26385   116.07913    -0.84811
   37    35 S   O2Z  _O32    31     1.26428   114.42807   179.20254
   38    33 S   CT   _C12    38     1.55939   108.61279   -78.40979
   39    38 S   HC   _H17    39     1.09720   110.06964    13.90525
   40    38 S   HC   _H18    40     1.09634   110.98162  -102.96718
   41    33 S   CT   _C14    69     1.57959   113.06520   151.36287
   42    41 S   OM   _O38    70     1.32796   110.00080    62.01290
   43    38 S   CT   _C11    41     1.54418   112.35463   133.89840
   44    43 S   HC   _H3_    42     1.08979   107.71287    55.87132
   45    41 S   CT   _C30    71     1.54786   111.94208   178.58847
   46    45 S   HC   _H41    72     1.09825   112.65914   -65.44177
   47    45 S   HC   _H42    73     1.09883   111.85053   174.87814
   48    45 S   HC   _H43    74     1.09049   112.09296    55.02360
   49    43 S   OS   _O35    43     1.45611   108.01464   -63.67891
   50    43 S   CM   _C9_    95     1.52473   112.30631   176.82220
   51    49 S   CO4  _C25    44     1.35715   125.63527   131.12211
   52    51 S   O    _O34    45     1.22818   120.60644  -178.58307
   53    50 S   CM   _C8_    96     1.35051   119.25401  -118.93421
   54    53 S   HC   _H13    97     1.08994   116.79095    -1.86561
   55    50 S   CT   _C10   108     1.50791   116.20431    61.85746
   56    55 S   HC   _H14   109     1.09441   110.27357   -85.97779
   57    55 S   HC   _H15   110     1.09312   112.67470   152.07913
   58    55 S   HC   _H16   111     1.09499   111.14732    33.81061
   59    51 S   CT   _C24    46     1.51273   116.73693     2.01684
   60    59 S   HC   _H25    47     1.08909   107.84939   -61.99708
   61    59 S   HC   _H26    48     1.09519   107.04287    57.30783
   62    53 S   C5B  _C6_    98     1.42935   128.89710   177.61263
   63    59 S   CT   _C23    49     1.53661   113.00740   177.47400
   64    63 S   HC   _H8_    50     1.09446   110.67397    44.03253
   65    62 S   C5A  _C7_    99     1.38045   123.41199   159.70435
   66    65 S   HA   _H12   100     1.08122   129.09087    -1.64770
   67    63 S   CT   _C22    51     1.56106   113.99874   167.16551
   68    63 S   OH   _O36    93     1.43395   107.18252   -71.60640
   69    68 S   HO   _H27    94     0.97356   107.42835    65.98555
   70    65 S   SA   _S1_   101     1.71449   109.70176   178.68657
   71    67 S   CO4  _C21    52     1.56766   110.52242   -73.91089
   72    71 S   O    _O33    53     1.23546   120.31989   104.94731
   73    67 S   CT   _C26    85     1.54828   111.05322    46.63574
   74    73 S   HC   _H28    86     1.09570   111.44093    56.31812
   75    73 S   HC   _H29    87     1.09542   112.25596   -64.73868
   76    73 S   HC   _H30    88     1.09677   110.85021   176.30292
   77    67 S   CT   _C27    89     1.54217   109.59777   163.01634
   78    77 S   HC   _H31    90     1.09627   111.83891   -62.51950
   79    77 S   HC   _H32    91     1.09508   111.13316   179.17837
   80    77 S   HC   _H33    92     1.09475   111.76344    57.67264
   81    70 S   CRA  _C5_   102     1.71918    89.47788    -0.82306
   82    71 S   CT   _C20    54     1.54007   120.14975   -76.03849
   83    82 S   HC   _H7_    55     1.09434   109.37426    28.47282
   84    62 S   N5B  _N4_   103     1.38006   121.09538   -23.24059
   85    81 S   CT   _C4_   104     1.48677   120.02848  -179.79729
   86    85 S   HC   _H9_   105     1.09460   110.85794   -60.24029
   87    85 S   HC   _H10   106     1.09460   110.84798    60.68328
   88    85 S   HC   _H11   107     1.09479   110.44837  -179.77358
   89    82 S   CT   _C19    56     1.55985   114.15174   151.24036
   90    89 S   HC   _H6_    57     1.09768   108.83220    58.58546
   91    82 S   CT   _C28    81     1.54426   108.01345   -89.28417
   92    91 S   HC   _H34    82     1.09623   110.77852   -64.32185
   93    91 S   HC   _H35    83     1.09488   111.59967   175.18419
   94    91 S   HC   _H36    84     1.08868   113.27203    55.73243
   95    89 S   CT   _C18    58     1.55108   120.07123   -67.52889
   96    95 S   HC   _H5_    59     1.09994   105.90296  -160.38081
   97    89 S   OH   _O37    79     1.44250   106.83666   172.38341
   98    97 S   HO   _H37    80     0.97258   107.59242  -167.06988
   99    95 S   CT   _C17    60     1.54216   113.39663    83.25134
  100    99 S   HC   _H23    61     1.09603   109.75734    37.32873
  101    99 S   HC   _H24    62     1.08822   108.83063   -80.68515
  102    95 S   CT   _C29    75     1.53122   112.81652   -45.51017
  103   102 S   HC   _H38    76     1.09154   111.49722    73.55028
  104   102 S   HC   _H39    77     1.09481   111.20639   -47.47123
  105   102 S   HC   _H40    78     1.09465   111.04875  -166.68774
  106    99 S   CT   _C16    63     1.53311   112.05685   157.77336
  107   106 S   HC   _H21    64     1.09848   108.01665   -51.28392
  108   106 S   HC   _H22    65     1.09307   110.10021    63.24728
  109   106 S   CT   _C15    66     1.54145   116.04247  -170.59326
  110   109 S   HC   _H19    67     1.10076   107.83863    59.44111
  111   109 S   HC   _H20    68     1.10199   105.38137   170.48603
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  18   8   2   1   1  13   6   5  13   8  13   5   7   3   2   1
   9  10   8   4  11   4   4   2   1   1  10   5   4   6  15   6
   5   3  16   4   1   6  19   6   8   3   2   1   4   2   1   1
   5  13   8   4   3   2   1   1  17   7   5   2   1   1  14   9
   3   1  12   6   5   4   2   1   1   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    41    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    43   109    41    42    45  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    43    44    49   106   109   110   111    41    42    45    46    47    48    50  
   38    39    40    43   109    41    42    45  
   36    37  
   37  
    0  
   39    40    43    44    49    51   109    41    42    45    50    53    55  
   40    43    44    49    41    50  
   43    44    49    41    50  
   42    45    46    47    48    43    99   106   107   108   109   110   111  
   45    46    47    48   106   109   110   111  
   44    49    51    52    59    50    53    54    62    55    56    57    58  
   49    51    50    53    55  
   46    47    48   106   109   110   111  
   47    48   109  
   48   109  
  109  
   51    52    59    60    61    63    50    53    55  
   53    54    62    65    84    55    56    57    58    51  
   52    59    60    61    63    64    67    68  
   59    60    61    63  
   54    62    65    66    70    81    84    55    56    57    58  
   62    65    84    55  
   56    57    58    62  
   57    58  
   58  
    0  
   60    61    63    64    67    71    73    77    68    69  
   61    63    64    67    68  
   63    64    67    68  
   65    66    70    81    84    85  
   64    67    71    72    82    73    74    75    76    77    78    79    80    68    69  
   67    71    73    77    68    69  
   66    70    81    84    85  
   70    81    84  
   71    72    82    83    89    91    73    74    75    76    77    78    79    80    68    69  
   69    71    73    77  
    0  
   81    84    85    86    87    88  
   72    82    83    89    90    95    97    91    92    93    94    73    74    75    76    77    78    79    80  
   82    83    89    91    73    77  
   74    75    76    77    78    79    80    82  
   75    76    77  
   76    77  
   77  
   78    79    80    82  
   79    80  
   80  
    0  
   84    85    86    87    88  
   83    89    90    95    96    99   102    97    98    91    92    93    94  
   89    90    95    97    91    92    93    94  
   85    86    87    88  
   86    87    88  
   87    88  
   88  
    0  
   90    95    96    99   100   101   106   102   103   104   105    97    98    91    92    93    94  
   95    96    99   102    97    98    91  
   92    93    94    95    97  
   93    94  
   94  
    0  
   96    99   100   101   106   107   108   109   102   103   104   105    97    98  
   99   100   101   106   102   103   104   105    97  
   98    99   102  
    0  
  100   101   106   107   108   109   110   111   102   103   104   105  
  101   106   107   108   109   102  
  106   107   108   109   102  
  103   104   105   106  
  104   105  
  105  
    0  
  107   108   109   110   111  
  108   109   110   111  
  109   110   111  
  110   111  
  111  
    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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   4.2000   0.3000  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   42   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   43   3.5000   0.0660   0.289000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   45   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   50   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   51   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   53   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   54   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   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   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   61   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   62   3.5500   0.0700   0.284300   2.0020   1.7750   0.001000000  -0.843144165
   63   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5500   0.0700  -0.337600   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.231700   1.3810   1.2100   0.030040813   0.268726247
   67   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   68   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   69   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   70   3.5600   0.3950   0.001000   2.0080   1.7800   0.025682759  -1.666211680
   71   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   72   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   73   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0700   0.185900   2.0020   1.7750   0.001000000  -0.843144165
   82   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   84   3.2800   0.1700  -0.480300   1.8650   1.6500   0.001000000  -0.511443539
   85   3.5000   0.0660  -0.065000   2.4950   1.7500   0.005000000  -0.741685710
   86   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   87   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   88   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   89   3.5000   0.0660   0.205000   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  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   98   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   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  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  107   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   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   268.000  1.529
   33    41   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    43   268.000  1.529
   43    44   340.000  1.090
   43    49   320.000  1.410
   43    50   317.000  1.510
   49    51   214.000  1.327
   51    52   570.000  1.229
   51    59   317.000  1.522
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    63   268.000  1.529
   63    64   340.000  1.090
   63    67   268.000  1.529
   63    68   320.000  1.410
   67    71   317.000  1.522
   67    73   268.000  1.529
   67    77   268.000  1.529
   71    72   570.000  1.229
   71    82   317.000  1.522
   82    83   340.000  1.090
   82    89   268.000  1.529
   82    91   268.000  1.529
   89    90   340.000  1.090
   89    95   268.000  1.529
   89    97   320.000  1.410
   95    96   340.000  1.090
   95    99   268.000  1.529
   95   102   268.000  1.529
   99   100   340.000  1.090
   99   101   340.000  1.090
   99   106   268.000  1.529
  106   107   340.000  1.090
  106   108   340.000  1.090
  106   109   268.000  1.529
  109   110   340.000  1.090
  109   111   340.000  1.090
  109    41   268.000  1.529
   41    42   570.000  1.307
   41    45   268.000  1.529
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   340.000  1.090
  102   103   340.000  1.090
  102   104   340.000  1.090
  102   105   340.000  1.090
   97    98   553.000  0.945
   91    92   340.000  1.090
   91    93   340.000  1.090
   91    94   340.000  1.090
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    76   340.000  1.090
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    80   340.000  1.090
   68    69   553.000  0.945
   50    53   549.000  1.340
   50    55   317.000  1.510
   53    54   340.000  1.080
   53    62   320.000  1.460
   62    65   520.000  1.370
   62    84   410.000  1.394
   65    66   367.000  1.080
   65    70   265.000  1.745
   70    81   250.000  1.765
   81    84   488.000  1.335
   81    85   295.000  1.488
   85    86   340.000  1.090
   85    87   340.000  1.090
   85    88   340.000  1.090
   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  111.63000
   29    33    41    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    43    58.35000  112.70000
   33    41   109    58.35000  112.70000
   33    41    42    50.00000  109.50000
   33    41    45    58.35000  112.70000
   38    33    34    37.50000  110.70000
   38    43    44    37.50000  110.70000
   38    43    49    50.00000  109.50000
   38    43    50    70.00000  112.02700
   40    38    39    33.00000  107.80000
   43    38    39    37.50000  110.70000
   43    38    40    37.50000  110.70000
   43    49    51    83.00000  116.90000
   43    50    53    70.00000  124.00000
   43    50    55    65.00000  117.92700
   49    43    44    35.00000  109.50000
   49    51    52    83.00000  123.40000
   49    51    59    81.00000  111.40000
   51    59    60    35.00000  109.50000
   51    59    61    35.00000  109.50000
   51    59    63    63.00000  111.10000
   59    51    52    80.00000  120.40000
   59    63    64    37.50000  110.70000
   59    63    67    58.35000  112.70000
   59    63    68    50.00000  109.50000
   61    59    60    33.00000  107.80000
   63    59    60    37.50000  110.70000
   63    59    61    37.50000  110.70000
   63    67    71    63.00000  111.10000
   63    67    73    58.35000  112.70000
   63    67    77    58.35000  112.70000
   63    68    69    55.00000  108.50000
   67    63    64    37.50000  110.70000
   67    71    72    80.00000  120.40000
   67    71    82    70.00000  116.00000
   67    73    74    37.50000  110.70000
   67    73    75    37.50000  110.70000
   67    73    76    37.50000  110.70000
   67    77    78    37.50000  110.70000
   67    77    79    37.50000  110.70000
   67    77    80    37.50000  110.70000
   71    82    83    35.00000  109.50000
   71    82    89    63.00000  111.10000
   71    82    91    63.00000  111.10000
   82    71    72    80.00000  120.40000
   82    89    90    37.50000  110.70000
   82    89    95    58.35000  112.70000
   82    89    97    50.00000  109.50000
   82    91    92    37.50000  110.70000
   82    91    93    37.50000  110.70000
   82    91    94    37.50000  110.70000
   89    82    83    37.50000  110.70000
   89    95    96    37.50000  110.70000
   89    95    99    58.35000  112.70000
   89    95   102    58.35000  112.70000
   89    97    98    55.00000  108.50000
   95    89    90    37.50000  110.70000
   95    99   100    37.50000  110.70000
   95    99   101    37.50000  110.70000
   95    99   106    58.35000  112.70000
   95   102   103    37.50000  110.70000
   95   102   104    37.50000  110.70000
   95   102   105    37.50000  110.70000
   99    95    96    37.50000  110.70000
   99   106   107    37.50000  110.70000
   99   106   108    37.50000  110.70000
   99   106   109    58.35000  112.70000
  101    99   100    33.00000  107.80000
  106    99   100    37.50000  110.70000
  106    99   101    37.50000  110.70000
  106   109   110    37.50000  110.70000
  106   109   111    37.50000  110.70000
  106   109    41    58.35000  112.70000
  108   106   107    33.00000  107.80000
  109   106   107    37.50000  110.70000
  109   106   108    37.50000  110.70000
  109    41    42    50.00000  109.50000
  109    41    45    58.35000  112.70000
  111   109   110    33.00000  107.80000
   41    33    34    37.50000  110.70000
   41    33    38    58.35000  112.70000
   41   109   110    37.50000  110.70000
   41   109   111    37.50000  110.70000
   41    45    46    37.50000  110.70000
   41    45    47    37.50000  110.70000
   41    45    48    37.50000  110.70000
   45    41    42    50.00000  109.50000
   47    45    46    33.00000  107.80000
   48    45    46    33.00000  107.80000
   48    45    47    33.00000  107.80000
  102    95    96    37.50000  110.70000
  102    95    99    58.35000  112.70000
  104   102   103    33.00000  107.80000
  105   102   103    33.00000  107.80000
  105   102   104    33.00000  107.80000
   97    89    90    35.00000  109.50000
   97    89    95    50.00000  109.50000
   91    82    83    37.50000  110.70000
   91    82    89    58.35000  112.70000
   93    91    92    33.00000  107.80000
   94    91    92    33.00000  107.80000
   94    91    93    33.00000  107.80000
   73    67    71    63.00000  111.10000
   75    73    74    33.00000  107.80000
   76    73    74    33.00000  107.80000
   76    73    75    33.00000  107.80000
   77    67    71    63.00000  111.10000
   77    67    73    58.35000  112.70000
   79    77    78    33.00000  107.80000
   80    77    78    33.00000  107.80000
   80    77    79    33.00000  107.80000
   68    63    64    35.00000  109.50000
   68    63    67    50.00000  109.50000
   50    43    44    35.00000  109.50000
   50    43    49    85.00000  110.90400
   50    53    54    35.00000  120.00000
   50    53    62    60.00000  123.20500
   50    55    56    35.00000  109.50000
   50    55    57    35.00000  109.50000
   50    55    58    35.00000  109.50000
   53    62    65    60.00000  120.93500
   53    62    84    70.00000  118.40000
   62    53    54    40.00000  117.26300
   62    65    66    35.00000  130.70000
   62    65    70    80.00000  111.29200
   62    84    81    70.00000  110.00000
   65    70    81   120.00000   89.04400
   70    65    66    40.00000  122.38200
   70    81    84    80.00000  114.57700
   70    81    85    65.00000  125.49400
   81    85    86    45.00000  109.19200
   81    85    87    45.00000  109.19200
   81    85    88    45.00000  109.19200
   84    62    65    70.00000  111.00000
   85    81    84    65.00000  125.57700
   87    85    86    33.00000  107.80000
   88    85    86    33.00000  107.80000
   88    85    87    33.00000  107.80000
   55    50    53    70.00000  124.00000
   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
    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
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
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   84    62    65    66   3.62500 -1.0 2.0
   84    62   -65    70   3.62500 -1.0 2.0
   84    81    85    86   0.00000  1.0 1.0
   84    81    85    87   0.00000  1.0 1.0
   84    81    85    88   0.00000  1.0 1.0
   85    81    84    62   3.62500 -1.0 2.0
   55    50    53    54   7.00000 -1.0 2.0
   55    50    53    62   7.00000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   49    59    51    52  10.50000 -1.0 2.0
   67    82    71    72  10.50000 -1.0 2.0
   43    55    50    53  15.00000 -1.0 2.0
   62    54    53    50  15.00000 -1.0 2.0
   65    84    62    53   4.00000 -1.0 2.0
   70    66    65    62   1.10000 -1.0 2.0
   85    84    81    70   4.00000 -1.0 2.0
END
