* LIGAND DATABASE FILE (OPLS2005)
*
001     112   113    213    320     634
    1     0 S   NP   _N1_     1    29.32470   100.18858   -22.18870
    2     1 S   H    _HN1     2     1.02939    49.16343   -16.27328
    3     1 S   H    _H1_     3     1.02822    58.05910   159.40697
    4     1 S   H    _H2_     4     1.02837   118.51621  -106.46687
    5     1 S   CT   _CA1     5     1.50117   129.19597    67.57443
    6     5 S   HC   _HA1     6     1.09557   105.15024   124.42463
    7     5 S   CO3  _C1_     7     1.53733   112.70546     4.00037
    8     7 S   O2Z  _O11     8     1.26417   115.08220   -38.73446
    9     7 S   O2Z  _O12     9     1.26250   115.19458   140.53646
   10     5 S   CT   _CB1    10     1.53055   107.39255  -117.28497
   11    10 S   HC   HB11    11     1.09852   109.59162   -46.09482
   12    10 S   HC   HB12    12     1.09806   110.43544    70.57892
   13    10 S   CT   _CG1    13     1.53027   112.52894  -166.81735
   14    13 S   HC   HG11    14     1.09535   111.14658   -68.12091
   15    13 S   HC   HG12    15     1.09594   109.31689    51.05158
   16    13 S   C    _CD1    16     1.51743   111.10873   172.10576
   17    16 S   O    _OE1    17     1.22819   122.62208    32.42257
   18    16 S   N    _N2_    18     1.38489   112.43030  -147.87578
   19    18 S   H    _HN2    19     1.01553   119.32469     0.72009
   20    18 S   CT1  _CA2    20     1.46226   123.45577   175.78077
   21    20 S   HC   _HA2    21     1.09725   109.27304     9.91861
   22    20 S   C    _C2_    22     1.53756   109.21800  -105.76976
   23    22 S   O    _O2_    23     1.23095   122.07907  -153.63632
   24    20 S   CT   _CB2    32     1.53231   111.19449   131.95728
   25    24 S   HC   HB21    33     1.09428   109.69834    58.09529
   26    24 S   HC   HB22    34     1.09514   110.74081   176.19945
   27    22 S   N    _N3_    24     1.38266   114.03692    33.73054
   28    27 S   H    _HN3    25     1.01503   119.53206    -3.36080
   29    24 S   S    _SG2    35     1.82997   111.23135   -64.85206
   30    27 S   CT   _CA3    26     1.45247   123.54344   177.51281
   31    30 S   HC   HA31    27     1.09540   107.53299   -65.12096
   32    30 S   HC   HA32    28     1.09550   108.01338    51.38984
   33    29 S   CT   _C8_    36     1.85137   100.17697   140.03306
   34    33 S   HC   _H4_    37     1.09744   104.38690    40.48717
   35    30 S   CO3  _C3_    29     1.53037   113.90379   173.38500
   36    35 S   O2Z  _O31    30     1.26418   116.10372     0.26980
   37    35 S   O2Z  _O32    31     1.26422   114.42099  -179.68973
   38    33 S   CM   _C9_    38     1.51096   107.74932   -75.52040
   39    38 S   HC   _H18    39     1.08650   114.90510   -56.54390
   40    33 S   CT   _C7_    58     1.57258   114.79686   156.31245
   41    38 S   CMA  _C10    40     1.35441   126.03715   123.20091
   42    41 S   OM   _O38    41     1.26331   130.32763    -0.24389
   43    40 S   CT   _C28    59     1.54501   110.57292   -51.03856
   44    43 S   HC   _H43    60     1.09683   110.69369  -167.30250
   45    43 S   HC   _H44    61     1.09306   113.04724    71.66421
   46    43 S   HC   _H45    62     1.09650   110.73055   -50.31340
   47    40 S   OH   _O39    63     1.45007   107.40029  -163.98337
   48    47 S   HO   _H46    64     0.97253   108.44735    42.93771
   49    41 S   CT   _C11    42     1.54930   118.37913   178.00208
   50    49 S   HC   _H5_    43     1.10042   109.95683  -162.17219
   51    49 S   CT   _C12    44     1.55505   114.56183   -42.57326
   52    51 S   HC   _H19    45     1.09470   108.04681    67.91261
   53    51 S   HC   _H20    46     1.09842   108.75502  -178.38517
   54    49 S   CT   _C27   109     1.53779   110.33651    81.03742
   55    54 S   HC   _H40   110     1.09444   111.27630   -66.50981
   56    54 S   HC   _H41   111     1.09549   110.54817   173.92833
   57    54 S   HC   _H42   112     1.09539   111.40761    54.27718
   58    51 S   CT   _C13    47     1.55137   114.46638   -56.22613
   59    58 S   HC   _H6_    48     1.09281   109.09178    41.75881
   60    58 S   CT   _C14    49     1.56060   113.22906   162.02905
   61    60 S   HC   _H7_    50     1.09926   107.38338    96.27341
   62    58 S   CT   _C26   105     1.53908   109.04762   -74.06985
   63    62 S   HC   _H37   106     1.09561   110.98835   -59.69871
   64    62 S   HC   _H38   107     1.09144   112.23994   179.88986
   65    62 S   HC   _H39   108     1.09414   111.23865    60.42145
   66    60 S   CT   _C15    51     1.55051   115.59405  -144.46224
   67    66 S   HC   _H8_    52     1.10099   104.91459  -174.56646
   68    60 S   OS   _O35    76     1.43615   111.57070   -23.17309
   69    66 S   CO4  _C16    53     1.52901   117.70625    71.43296
   70    69 S   O    _O33    54     1.22917   120.89469   162.59727
   71    66 S   CT   _C17    72     1.52560   114.09635   -57.22465
   72    71 S   HC   _H21    73     1.09478   111.59109    70.93749
   73    71 S   HC   _H22    74     1.09437   111.09239   -51.15657
   74    71 S   HC   _H23    75     1.09610   110.77367  -170.28034
   75    68 S   CO   _C18    77     1.43276   113.86400   121.58107
   76    75 S   HC   _H9_    78     1.09834   108.48612    52.00912
   77    69 S   OS   _O34    55     1.36211   114.14546   -18.67040
   78    75 S   CT   _C19    79     1.53726   107.12657   171.03220
   79    78 S   HC   _H10    80     1.09517   108.71183    51.85243
   80    77 S   CT   _C6_    56     1.45746   117.71454  -176.46537
   81    80 S   HC   _H3_    57     1.09783   108.42700    10.68489
   82    78 S   CT   _C20    81     1.53452   110.32098   173.87522
   83    82 S   HC   _H11    82     1.09845   107.84520    68.57694
   84    78 S   OH   _O37   103     1.42872   110.50581   -65.43036
   85    84 S   HO   _H36   104     0.97254   108.48554   -47.92606
   86    80 S   CT   _C5_    65     1.53607   108.65238  -106.00579
   87    86 S   HC   _H16    66     1.09428   110.40825  -173.48853
   88    86 S   HC   _H17    67     1.09454   110.37567   -53.74733
   89    82 S   CT   _C21    83     1.52685   111.26002   -51.47535
   90    89 S   HC   _H24    84     1.09517   111.06381   174.97340
   91    89 S   HC   _H25    85     1.09630   109.96224   -65.72158
   92    82 S   NP   _N4_    93     1.52630   110.30091  -177.51446
   93    92 S   H    _H29    94     1.03013   104.87809   -43.39903
   94    86 S   CT   _C4_    68     1.52460   112.68709    65.88691
   95    94 S   HC   _H13    69     1.09302   111.43113   -62.96468
   96    94 S   HC   _H14    70     1.09475   110.05958   177.63802
   97    94 S   HC   _H15    71     1.09449   111.02309    58.10469
   98    89 S   CT   _C22    86     1.53085   109.14503    53.34876
   99    98 S   HC   _H12    87     1.09731   110.56601    62.42381
  100    92 S   CT   _C24    95     1.50608   116.24682    72.58221
  101   100 S   HC   _H30    96     1.09237   108.91037    69.91509
  102   100 S   HC   _H31    97     1.09371   107.69238  -170.52373
  103   100 S   HC   _H32    98     1.09055   108.88653   -52.10626
  104    92 S   CT   _C25    99     1.50685   112.74507  -157.72679
  105   104 S   HC   _H33   100     1.09251   108.85764   -67.66577
  106   104 S   HC   _H34   101     1.09302   108.28205    53.35289
  107   104 S   HC   _H35   102     1.09341   107.99132   171.99156
  108    75 S   OS   _O36    88     1.42907   110.59326   -68.80269
  109    98 S   CT   _C23    89     1.52240   111.08505  -176.76179
  110   109 S   HC   _H26    90     1.09572   111.04868    61.16525
  111   109 S   HC   _H27    91     1.09413   111.34172   -60.20542
  112   109 S   HC   _H28    92     1.09545   110.31870   179.13227
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  17   7   2   1   1  11   4  15  11   4   9   4   3   2   5   1
  12   8  16   6   5   4   2   1   1  13   8  19   7   5   2   1
   1  11   8  10   9   3   4   2   1   1  13   6   6  14   7   8
   4  20   9   4   1   6   5   4  13   6   5  10   8   3   2   1
   1   6   5   7   3   2   1   3   2   1   1   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    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    41    80    40    43    47  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    41    42    49    77    80    81    40    43    44    45    46    47    48    86  
   38    39    41    80    40    43    47  
   36    37  
   37  
    0  
   39    41    42    49    50    51    80    40    43    47    54  
   41    42    49    40  
   43    44    45    46    47    48    86    87    88    94    41    69    77    80    81  
   42    49    50    51    52    53    58    54    55    56    57  
   49    50    51    54  
   44    45    46    47    48    86    77    80    81  
   45    46    47    80  
   46    47    80  
   47    80  
   48    86    77    80    81  
   80  
   50    51    52    53    58    59    60    62    54    55    56    57  
   51    52    53    58    54    55    56    57  
   52    53    58    59    60    61    66    68    62    63    64    65    54    55    56    57  
   53    58    59    60    62    54  
   58    59    60    62    54  
   55    56    57    58  
   56    57  
   57  
    0  
   59    60    61    66    67    69    71    68    75    62    63    64    65  
   60    61    66    68    62    63    64    65  
   61    66    67    69    70    77    71    72    73    74    68    75    76    78   108    62    63    64    65  
   66    67    69    71    68    75    62  
   63    64    65    66    68  
   64    65  
   65  
    0  
   67    69    70    77    80    71    72    73    74    68    75  
   69    70    77    71    72    73    74    68  
   75    76    78    79    82    98   108    84    69    71  
   70    77    80    81    86    71    72    73    74  
   77    80    71  
   72    73    74    77  
   73    74  
   74  
    0  
   76    78    79    82    83    89    98    99   108   109    92    84    85  
   78    79    82    98   108    84  
   80    81    86    87    88    94  
   79    82    83    89    90    91    98   108    92    93   100   104    84    85  
   82    83    89   108    92    84    85  
   81    86    87    88    94    95    96    97  
   86    87    88    94  
   83    89    90    91    98    99   108   109    92    93   100   101   102   103   104   105   106   107    84    85  
   89    90    91    98    92    93   100   104    84  
   85    89    92   108  
    0  
   87    88    94    95    96    97  
   88    94    95    96    97  
   94    95    96    97  
   90    91    98    99   108   109   110   111   112    92    93   100   104  
   91    98    99   108   109    92  
   98    99   108   109    92  
   93   100   101   102   103   104   105   106   107    98  
  100   101   102   103   104   105   106   107  
   95    96    97  
   96    97  
   97  
    0  
   99   108   109   110   111   112  
  108   109   110   111   112  
  101   102   103   104   105   106   107  
  102   103   104  
  103   104  
  104  
  105   106   107  
  106   107  
  107  
    0  
  109   110   111   112  
  110   111   112  
  111   112  
  112  
    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  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   41   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   48   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   49   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   68   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   69   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   70   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   71   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   0.100000   1.6450   1.4500   0.008598240   0.268726247
   77   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   78   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   80   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   82   3.5000   0.0660   0.210000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   84   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   85   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   86   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   91   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   92   3.2500   0.1700  -0.100000   2.1950   1.9500   0.003973653   1.685851020
   93   0.5000   0.0300   0.290000   0.9960   0.8600   0.030040813  -0.651083722
   94   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.5000   0.0300   0.030000   1.6450   1.4500   0.008598240   0.268726247
  100   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
  101   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  102   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  103   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  104   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
  105   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  106   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  107   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  108   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
  109   3.5000   0.0660  -0.180000   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
  112   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   268.000  1.529
   38    39   340.000  1.080
   38    41   465.000  1.376
   41    42   745.000  1.250
   41    49   270.000  1.512
   49    50   340.000  1.090
   49    51   268.000  1.529
   49    54   268.000  1.529
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    58   268.000  1.529
   58    59   340.000  1.090
   58    60   268.000  1.529
   58    62   268.000  1.529
   60    61   340.000  1.090
   60    66   268.000  1.529
   60    68   320.000  1.410
   66    67   340.000  1.090
   66    69   317.000  1.522
   66    71   268.000  1.529
   69    70   570.000  1.229
   69    77   214.000  1.327
   77    80   320.000  1.410
   80    81   340.000  1.090
   80    40   268.000  1.529
   80    86   268.000  1.529
   40    43   268.000  1.529
   40    47   320.000  1.410
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    46   340.000  1.090
   47    48   553.000  0.945
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    94   268.000  1.529
   94    95   340.000  1.090
   94    96   340.000  1.090
   94    97   340.000  1.090
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   340.000  1.090
   68    75   320.000  1.380
   75    76   340.000  1.090
   75    78   250.000  1.527
   75   108   320.000  1.380
   78    79   340.000  1.090
   78    82   268.000  1.529
   78    84   320.000  1.410
   82    83   340.000  1.090
   82    89   268.000  1.529
   82    92   367.000  1.471
   89    90   340.000  1.090
   89    91   340.000  1.090
   89    98   268.000  1.529
   98    99   340.000  1.090
   98   108   320.000  1.410
   98   109   268.000  1.529
  109   110   340.000  1.090
  109   111   340.000  1.090
  109   112   340.000  1.090
   92    93   434.000  1.010
   92   100   367.000  1.471
   92   104   367.000  1.471
  100   101   340.000  1.090
  100   102   340.000  1.090
  100   103   340.000  1.090
  104   105   340.000  1.090
  104   106   340.000  1.090
  104   107   340.000  1.090
   84    85   553.000  0.945
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    40    75.00000  111.63000
   33    38    39    35.00000  117.00000
   33    38    41    70.00000  124.00000
   33    40    80    58.35000  112.70000
   33    40    43    58.35000  112.70000
   33    40    47    50.00000  109.50000
   38    33    34    35.00000  109.50000
   38    41    42    65.00000  137.10300
   38    41    49    65.00000  122.18000
   41    38    39    40.00000  120.50800
   41    49    50    45.00000  110.52000
   41    49    51    70.00000  112.02700
   41    49    54    70.00000  112.02700
   49    41    42    85.00000  112.85300
   49    51    52    37.50000  110.70000
   49    51    53    37.50000  110.70000
   49    51    58    58.35000  112.70000
   49    54    55    37.50000  110.70000
   49    54    56    37.50000  110.70000
   49    54    57    37.50000  110.70000
   51    49    50    37.50000  110.70000
   51    58    59    37.50000  110.70000
   51    58    60    58.35000  112.70000
   51    58    62    58.35000  112.70000
   53    51    52    33.00000  107.80000
   58    51    52    37.50000  110.70000
   58    51    53    37.50000  110.70000
   58    60    61    37.50000  110.70000
   58    60    66    58.35000  112.70000
   58    60    68    50.00000  109.50000
   58    62    63    37.50000  110.70000
   58    62    64    37.50000  110.70000
   58    62    65    37.50000  110.70000
   60    58    59    37.50000  110.70000
   60    66    67    37.50000  110.70000
   60    66    69    63.00000  111.10000
   60    66    71    58.35000  112.70000
   60    68    75    60.00000  109.50000
   66    60    61    37.50000  110.70000
   66    69    70    80.00000  120.40000
   66    69    77    81.00000  111.40000
   66    71    72    37.50000  110.70000
   66    71    73    37.50000  110.70000
   66    71    74    37.50000  110.70000
   69    66    67    35.00000  109.50000
   69    77    80    83.00000  116.90000
   77    69    70    83.00000  123.40000
   77    80    81    35.00000  109.50000
   77    80    40    50.00000  109.50000
   77    80    86    50.00000  109.50000
   80    40    43    58.35000  112.70000
   80    40    47    50.00000  109.50000
   80    86    87    37.50000  110.70000
   80    86    88    37.50000  110.70000
   80    86    94    58.35000  112.70000
   40    33    34    37.50000  110.70000
   40    33    38    70.00000  112.02700
   40    80    81    37.50000  110.70000
   40    43    44    37.50000  110.70000
   40    43    45    37.50000  110.70000
   40    43    46    37.50000  110.70000
   40    47    48    55.00000  108.50000
   45    43    44    33.00000  107.80000
   46    43    44    33.00000  107.80000
   46    43    45    33.00000  107.80000
   47    40    43    50.00000  109.50000
   86    80    81    37.50000  110.70000
   86    80    40    58.35000  112.70000
   86    94    95    37.50000  110.70000
   86    94    96    37.50000  110.70000
   86    94    97    37.50000  110.70000
   88    86    87    33.00000  107.80000
   94    86    87    37.50000  110.70000
   94    86    88    37.50000  110.70000
   96    94    95    33.00000  107.80000
   97    94    95    33.00000  107.80000
   97    94    96    33.00000  107.80000
   71    66    67    37.50000  110.70000
   71    66    69    63.00000  111.10000
   73    71    72    33.00000  107.80000
   74    71    72    33.00000  107.80000
   74    71    73    33.00000  107.80000
   68    60    61    35.00000  109.50000
   68    60    66    50.00000  109.50000
   68    75    76    35.00000  109.50000
   68    75    78    90.00000  108.56700
   68    75   108    92.60000  111.55000
   75    78    79    45.00000  108.72000
   75    78    82    75.00000  109.43000
   75    78    84    90.00000  111.58700
   75   108    98    60.00000  109.50000
   78    75    76    45.00000  112.01100
   78    82    83    37.50000  110.70000
   78    82    89    58.35000  112.70000
   78    82    92    80.00000  111.20000
   78    84    85    55.00000  108.50000
   82    78    79    37.50000  110.70000
   82    89    90    37.50000  110.70000
   82    89    91    37.50000  110.70000
   82    89    98    58.35000  112.70000
   82    92    93    35.00000  109.50000
   82    92   100    75.00000  113.01200
   82    92   104    75.00000  113.01200
   89    82    83    37.50000  110.70000
   89    98    99    37.50000  110.70000
   89    98   108    50.00000  109.50000
   89    98   109    58.35000  112.70000
   91    89    90    33.00000  107.80000
   98    89    90    37.50000  110.70000
   98    89    91    37.50000  110.70000
   98   109   110    37.50000  110.70000
   98   109   111    37.50000  110.70000
   98   109   112    37.50000  110.70000
  108    75    76    35.00000  109.50000
  108    75    78    90.00000  108.56700
  108    98    99    35.00000  109.50000
  109    98    99    37.50000  110.70000
  109    98   108    50.00000  109.50000
  111   109   110    33.00000  107.80000
  112   109   110    33.00000  107.80000
  112   109   111    33.00000  107.80000
   92    82    83    35.00000  109.50000
   92    82    89    80.00000  111.20000
   92   100   101    35.00000  109.50000
   92   100   102    35.00000  109.50000
   92   100   103    35.00000  109.50000
   92   104   105    35.00000  109.50000
   92   104   106    35.00000  109.50000
   92   104   107    35.00000  109.50000
  100    92    93    35.00000  109.50000
  102   100   101    33.00000  107.80000
  103   100   101    33.00000  107.80000
  103   100   102    33.00000  107.80000
  104    92    93    35.00000  109.50000
  104    92   100    75.00000  113.01200
  106   104   105    33.00000  107.80000
  107   104   105    33.00000  107.80000
  107   104   106    33.00000  107.80000
   84    78    79    35.00000  109.50000
   84    78    82    50.00000  109.50000
   62    58    59    37.50000  110.70000
   62    58    60    58.35000  112.70000
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    33.00000  107.80000
   54    49    50    37.50000  110.70000
   54    49    51    58.35000  112.70000
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    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
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  108    75    78    84  -1.82950 -1.0 2.0
  108    98   109   110   0.23400  1.0 3.0
  108    98   109   111   0.23400  1.0 3.0
  108    98   109   112   0.23400  1.0 3.0
  109    98   108    75   0.06250  1.0 1.0
  109    98   108    75  -0.01100 -1.0 2.0
  109    98   108    75   0.28050  1.0 3.0
   92    82    89    90   0.19200  1.0 3.0
   92    82    89    91   0.19200  1.0 3.0
   92    82    89    98   1.36600  1.0 1.0
   92    82    89    98  -0.11450 -1.0 2.0
   92    82    89    98   0.24250  1.0 3.0
   93    92   100   101   0.13050  1.0 3.0
   93    92   100   102   0.13050  1.0 3.0
   93    92   100   103   0.13050  1.0 3.0
   93    92   104   105   0.13050  1.0 3.0
   93    92   104   106   0.13050  1.0 3.0
   93    92   104   107   0.13050  1.0 3.0
  100    92   104   105   0.15000  1.0 3.0
  100    92   104   106   0.15000  1.0 3.0
  100    92   104   107   0.15000  1.0 3.0
  104    92   100   101   0.15000  1.0 3.0
  104    92   100   102   0.15000  1.0 3.0
  104    92   100   103   0.15000  1.0 3.0
   84    78    82    83   0.23400  1.0 3.0
   84    78    82    89   0.86500  1.0 1.0
   84    78    82    89  -0.17500 -1.0 2.0
   84    78    82    89   0.20800  1.0 3.0
   84    78    82    92   1.69300  1.0 1.0
   84    78    82    92  -0.48450 -1.0 2.0
   62    58    60    61   0.15000  1.0 3.0
   62    58    60    66   0.56750  1.0 1.0
   62    58    60    66  -0.07550 -1.0 2.0
   62    58    60    66   0.20000  1.0 3.0
   62    58    60    68   0.62750  1.0 1.0
   62    58    60    68  -0.30950 -1.0 2.0
   62    58    60    68   0.27300  1.0 3.0
   54    49    51    52   0.15000  1.0 3.0
   54    49    51    53   0.15000  1.0 3.0
   54    49    51    58   0.56750  1.0 1.0
   54    49    51    58  -0.07550 -1.0 2.0
   54    49    51    58   0.20000  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   33    39    38    41   1.10000 -1.0 2.0
   49    42    41    38   1.10000 -1.0 2.0
   66    77    69    70  10.50000 -1.0 2.0
END
