* LIGAND DATABASE FILE (OPLS2005)
*
001     108   111    208    329     628
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.01992   100.51295    19.19617
    3     1 S   H    _H1_     3     1.02096    37.91077   126.19299
    4     1 S   H    _H2_     4     1.02139    77.03503   -87.79361
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08638   110.54412    58.84088
   26    24 S   HC   HB22    34     1.08575   109.90351   179.01802
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C23    36     1.82009    98.19487   -78.13025
   34    33 S   HC   _H30    37     1.09545   108.27871    39.95693
   35    33 S   HC   _H31    38     1.09486   107.34289   -75.90855
   36    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   37    36 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   38    36 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   39    33 S   CT   _C22    39     1.52813   112.31148   163.02488
   40    39 S   HC   _H17    40     1.09593   111.60370    55.52633
   41    39 S   CT   _C21    41     1.52440   111.48944   178.55788
   42    41 S   HC   _H16    42     1.09567   107.82346    56.70371
   43    39 S   NP   _N5_   105     1.49081   109.54602   -62.19786
   44    43 S   H    _H32   106     1.02353   110.53476  -117.64603
   45    43 S   H    _H33   107     1.02337   110.58094   122.42484
   46    43 S   H    _H34   108     1.02301   110.61019     2.31004
   47    41 S   CT   _C20    43     1.53349   112.51586   -64.15327
   48    47 S   HC   _H15    44     1.09558   110.74033    64.09109
   49    47 S   CT   _C19    45     1.53215   109.66555  -174.63049
   50    49 S   HC   _H14    46     1.09426   108.71303   -67.49176
   51    47 S   OH   _O41   103     1.42714   109.42683   -53.42064
   52    51 S   HO   _H35   104     0.96951   106.43262   179.23281
   53    49 S   CT   _C18    47     1.53170   111.42613    52.50586
   54    53 S   HC   _H13    48     1.09610   109.70989  -175.96808
   55    49 S   OH   _O42   101     1.42264   110.77541   175.03825
   56    55 S   HO   _H36   102     0.97051   106.68352    60.03464
   57    53 S   CO   _C17    49     1.53671   110.26687   -52.87202
   58    53 S   OH   _O43    99     1.42948   110.07906    66.98393
   59    58 S   HO   _H37   100     0.96867   106.37118    60.03018
   60    57 S   OS   _O38    50     1.43550   109.34854   -68.06258
   61    41 S   OS   _O40    98     1.43511   107.14102   173.50336
   62    60 S   CT   _C13    51     1.43061   107.02520  -114.56463
   63    62 S   HC   _H10    52     1.08238   110.33658   100.69907
   64    62 S   CT   _C12    53     1.51624   105.30168   -18.86253
   65    64 S   HC   _H9_    54     1.09287   111.92030   143.14967
   66    64 S   CO   _C11    55     1.53587   112.44793   -93.37995
   67    66 S   HC   _H8_    56     1.09042   108.80037   -84.99480
   68    57 S   OS   _O39    97     1.43642   107.72025   173.86291
   69    66 S   OS   _O35    57     1.42558   109.97221    33.53122
   70    66 S   OS   _O34    69     1.42207   109.48070   156.52749
   71    69 S   CT   _C15    58     1.43911   112.52849   -69.68933
   72    71 S   HC   _H12    59     1.12419   107.38042   -80.37496
   73    70 S   CT   _C9_    70     1.42784   111.42500   178.61266
   74    73 S   HC   _H6_    71     1.08887   106.94057    30.06562
   75    62 S   CT   _C14    60     1.52565   109.91769  -138.86226
   76    75 S   HC   _H11    61     1.12677   107.47261  -178.13586
   77    71 S   CT   _C16    64     1.52531   107.17301   165.64376
   78    77 S   HC   _H26    65     1.09134   110.02581   -65.22052
   79    77 S   HC   _H27    66     1.09012   110.08986   173.81902
   80    73 S   CT   _C8_    72     1.53611   108.70254   149.74458
   81    80 S   HC   _H5_    73     1.11007   109.23088    54.56868
   82    75 S   OH   _O37    62     1.42067   110.77062   -63.78189
   83    82 S   HO   _H29    63     0.96855   106.49690   -60.01419
   84    77 S   OH   _O36    67     1.41641   108.65835    54.26823
   85    84 S   HO   _H28    68     0.97157   107.11896  -179.98022
   86    80 S   CT   _C7_    74     1.54274   112.78391   175.34284
   87    86 S   HC   _H4_    75     1.10088   108.47521  -170.92500
   88    80 S   OH   _O44    95     1.42850   109.06935   -62.07332
   89    88 S   HO   _H38    96     0.96939   106.45578   175.73364
   90    86 S   CT   _C6_    76     1.53670   110.96930   -51.91333
   91    90 S   HC   _H23    77     1.09652   109.75888   172.29314
   92    90 S   HC   _H24    78     1.09492   110.14802   -70.64507
   93    86 S   NTH2 _N6_    92     1.46854   111.81632    71.13431
   94    93 S   H    _H39    93     0.99527   117.81216  -157.97167
   95    93 S   H    _H40    94     0.99514   117.88548    35.42906
   96    90 S   CT   _C5_    79     1.53446   112.10218    51.95798
   97    96 S   HC   _H3_    80     1.09417   110.64185    68.31924
   98    73 S   CT   _C10    81     1.53665   109.44516   -88.28413
   99    98 S   HC   _H7_    82     1.05724   109.71470    62.84519
  100    96 S   NP   _N4_    85     1.48878   108.70182  -177.19063
  101   100 S   H    _H21    86     1.02734   108.82840   -55.79927
  102   100 S   H    _H22    87     1.02739   108.80567    59.26607
  103    98 S   OH   _O33    83     1.42995   108.03605   -55.85306
  104   103 S   HO   _H25    84     0.97020   106.55775   -60.14302
  105   100 S   CT   _C4_    88     1.48482   114.07436  -178.29785
  106   105 S   HC   _H18    89     1.09113   107.82294   -57.80050
  107   105 S   HC   _H19    90     1.09193   107.81257    62.25880
  108   105 S   HC   _H20    91     1.09181   107.79086  -177.79158
  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   7   5   4   3
  12   5   4   2   1   1  13   8  17   7   5   2   1   1  12   7
  13   7   4   1  11   7   3   1  11   4   1  11   3  15   8  11
   6  12   5   3  11  11  10   7  16   8   7   3   5   3   2  15
   7   1   1   1   1  13   8   4   1  14   6   5   3   1   1  12
   7   7   3   7   5   4   1   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    43  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    47    61    43    44    45    46  
   35    39    40    41    43  
   39    40    41    43  
   37    38  
   38  
    0  
   40    41    42    47    48    49    57    61    51    43    44    45    46  
   41    42    47    61    43    44    45    46  
   42    47    48    49    50    53    57    60    68    61    55    51    52    43    44    45    46  
   47    48    49    57    61    51    43  
   44    45    46    47    61  
   45    46  
   46  
    0  
   48    49    50    53    54    57    61    58    55    56    51    52  
   49    50    53    61    55    51    52  
   50    53    54    57    60    68    61    58    59    55    56    51    52  
   53    54    57    58    55    56    51  
   52    53    55    61  
    0  
   54    57    60    62    64    68    61    58    59    55    56  
   57    60    68    61    58    59    55  
   56    57    58  
    0  
   60    62    63    64    65    66    75    68    61    58    59  
   59    60    61    68  
    0  
   62    63    64    65    66    71    75    76    82    68    61  
   62    64    68  
   63    64    65    66    67    69    71    72    75    76    82    83    77    70    68  
   64    65    66    71    75    76    82    68  
   65    66    67    69    71    75    76    82    70    73    68  
   66    67    69    75    70    68  
   67    69    71    72    75    77    70    73    74    80    98    68  
   69    71    70    73    68  
   69    70    75  
   71    72    75    76    82    77    78    79    84    70    73  
   73    74    80    81    86    96    98    99   103    88    71  
   72    75    76    82    83    77    78    79    84    85  
   75    76    82    77    78    79    84  
   74    80    81    86    87    90    96    97    98    99   103   104   100    93    88    89  
   80    81    86    96    98    99   103    88  
   76    82    83    77    78    79    84  
   82    83    77  
   78    79    84    85    82  
   79    84    85  
   84    85  
   81    86    87    90    91    92    96    98    99   103    93    94    95    88    89  
   86    87    90    98    93    88    89  
   83  
    0  
   85  
    0  
   87    90    91    92    96    97    98   100    93    94    95    88    89  
   90    91    92    96    93    94    95    88  
   89    90    93    98  
    0  
   91    92    96    97    98    99   103   100   101   102   105    93    94    95  
   92    96    97    98   100    93  
   96    97    98   100    93  
   94    95    96  
   95  
    0  
   97    98    99   103   104   100   101   102   105   106   107   108  
   98    99   103   100   101   102   105  
   99   103   104   100   101   102   105  
  103   104   100  
  101   102   105   106   107   108   103  
  102   105   106   107   108  
  105   106   107   108  
  104  
    0  
  106   107   108  
  107   108  
  108  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660   0.025600   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   41   3.5000   0.0660   0.394400   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.030000   1.6450   1.4500   0.008598240   0.268726247
   43   3.2500   0.1700  -0.300000   2.1950   1.9500   0.003973653   1.685851020
   44   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   45   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   46   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   47   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   49   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   52   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   53   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   56   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   57   3.5000   0.0660   0.600000   1.9750   1.7500   0.005000000  -0.741685710
   58   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   59   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   60   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   61   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   62   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   68   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   69   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   70   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   71   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   73   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.030000   1.6450   1.4500   0.008598240   0.268726247
   75   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   3.5000   0.0660   0.145000   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   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   83   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   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   0.0150   0.060000   1.6450   1.4500   0.008598240   0.268726247
   88   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   89   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   90   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   92   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   93   3.3000   0.1700  -0.900000   1.8650   1.6500   0.051222218  -2.220205820
   94   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   95   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   96   3.5000   0.0660   0.230000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   98   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  100   3.2500   0.1700  -0.200000   2.1950   1.9500   0.003973653   1.685851020
  101   0.5000   0.0300   0.310000   0.9960   0.8600   0.030040813  -0.651083722
  102   0.5000   0.0300   0.310000   0.9960   0.8600   0.030040813  -0.651083722
  103   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  104   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  105   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
  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   2.5000   0.0300   0.060000   1.6450   1.4500   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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   268.000  1.529
   39    43   367.000  1.471
   41    42   340.000  1.090
   41    47   268.000  1.529
   41    61   320.000  1.410
   47    48   340.000  1.090
   47    49   268.000  1.529
   47    51   320.000  1.410
   49    50   340.000  1.090
   49    53   268.000  1.529
   49    55   320.000  1.410
   53    54   340.000  1.090
   53    57   250.000  1.527
   53    58   320.000  1.410
   57    60   320.000  1.380
   57    68   320.000  1.380
   57    61   320.000  1.380
   60    62   320.000  1.410
   62    63   340.000  1.090
   62    64   268.000  1.529
   62    75   268.000  1.529
   64    65   340.000  1.090
   64    66   250.000  1.527
   64    68   320.000  1.410
   66    67   340.000  1.090
   66    69   320.000  1.380
   66    70   320.000  1.380
   69    71   320.000  1.410
   71    72   340.000  1.090
   71    75   268.000  1.529
   71    77   268.000  1.529
   75    76   340.000  1.090
   75    82   320.000  1.410
   82    83   553.000  0.945
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    84   320.000  1.410
   84    85   553.000  0.945
   70    73   320.000  1.410
   73    74   340.000  1.090
   73    80   268.000  1.529
   73    98   268.000  1.529
   80    81   340.000  1.090
   80    86   268.000  1.529
   80    88   320.000  1.410
   86    87   340.000  1.090
   86    90   268.000  1.529
   86    93   300.000  1.468
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    96   268.000  1.529
   96    97   340.000  1.090
   96    98   268.000  1.529
   96   100   367.000  1.471
   98    99   340.000  1.090
   98   103   320.000  1.410
  103   104   553.000  0.945
  100   101   434.000  1.010
  100   102   434.000  1.010
  100   105   367.000  1.471
  105   106   340.000  1.090
  105   107   340.000  1.090
  105   108   340.000  1.090
   93    94   495.000  1.019
   93    95   495.000  1.019
   88    89   553.000  0.945
   58    59   553.000  0.945
   55    56   553.000  0.945
   51    52   553.000  0.945
   43    44   434.000  1.010
   43    45   434.000  1.010
   43    46   434.000  1.010
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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    58.35000  112.70000
   33    39    43    80.00000  111.20000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    37.50000  110.70000
   39    41    47    58.35000  112.70000
   39    41    61    50.00000  109.50000
   39    43    44    35.00000  109.50000
   39    43    45    35.00000  109.50000
   39    43    46    35.00000  109.50000
   41    39    40    37.50000  110.70000
   41    47    48    37.50000  110.70000
   41    47    49    58.35000  112.70000
   41    47    51    50.00000  109.50000
   41    61    57    60.00000  109.50000
   47    41    42    37.50000  110.70000
   47    49    50    37.50000  110.70000
   47    49    53    58.35000  112.70000
   47    49    55    50.00000  109.50000
   47    51    52    55.00000  108.50000
   49    47    48    37.50000  110.70000
   49    53    54    37.50000  110.70000
   49    53    57    75.00000  109.43000
   49    53    58    50.00000  109.50000
   49    55    56    55.00000  108.50000
   53    49    50    37.50000  110.70000
   53    57    60    90.00000  108.56700
   53    57    68    90.00000  108.56700
   53    57    61    90.00000  108.56700
   53    58    59    55.00000  108.50000
   57    53    54    45.00000  108.72000
   57    60    62    60.00000  109.50000
   57    68    64    60.00000  109.50000
   60    62    63    35.00000  109.50000
   60    62    64    50.00000  109.50000
   60    62    75    50.00000  109.50000
   62    64    65    37.50000  110.70000
   62    64    66    75.00000  109.43000
   62    64    68    50.00000  109.50000
   62    75    71    58.35000  112.70000
   62    75    76    37.50000  110.70000
   62    75    82    50.00000  109.50000
   64    62    63    37.50000  110.70000
   64    66    67    45.00000  112.01100
   64    66    69    90.00000  108.56700
   64    66    70    90.00000  108.56700
   66    64    65    45.00000  108.72000
   66    69    71    60.00000  109.50000
   66    70    73    60.00000  109.50000
   69    66    67    35.00000  109.50000
   69    71    72    35.00000  109.50000
   69    71    75    50.00000  109.50000
   69    71    77    50.00000  109.50000
   71    75    76    37.50000  110.70000
   71    75    82    50.00000  109.50000
   71    77    78    37.50000  110.70000
   71    77    79    37.50000  110.70000
   71    77    84    50.00000  109.50000
   75    62    63    37.50000  110.70000
   75    62    64    58.35000  112.70000
   75    71    72    37.50000  110.70000
   75    82    83    55.00000  108.50000
   82    75    76    35.00000  109.50000
   77    71    72    37.50000  110.70000
   77    71    75    58.35000  112.70000
   77    84    85    55.00000  108.50000
   79    77    78    33.00000  107.80000
   84    77    78    35.00000  109.50000
   84    77    79    35.00000  109.50000
   70    66    67    35.00000  109.50000
   70    66    69    92.60000  111.55000
   70    73    74    35.00000  109.50000
   70    73    80    50.00000  109.50000
   70    73    98    50.00000  109.50000
   73    80    81    37.50000  110.70000
   73    80    86    58.35000  112.70000
   73    80    88    50.00000  109.50000
   73    98    96    58.35000  112.70000
   73    98    99    37.50000  110.70000
   73    98   103    50.00000  109.50000
   80    73    74    37.50000  110.70000
   80    86    87    37.50000  110.70000
   80    86    90    58.35000  112.70000
   80    86    93    80.00000  112.76400
   80    88    89    55.00000  108.50000
   86    80    81    37.50000  110.70000
   86    90    91    37.50000  110.70000
   86    90    92    37.50000  110.70000
   86    90    96    58.35000  112.70000
   86    93    94    50.00000  110.30900
   86    93    95    50.00000  110.30900
   90    86    87    37.50000  110.70000
   90    96    97    37.50000  110.70000
   90    96    98    58.35000  112.70000
   90    96   100    80.00000  111.20000
   92    90    91    33.00000  107.80000
   96    90    91    37.50000  110.70000
   96    90    92    37.50000  110.70000
   96    98    99    37.50000  110.70000
   96    98   103    50.00000  109.50000
   96   100   101    35.00000  109.50000
   96   100   102    35.00000  109.50000
   96   100   105    75.00000  113.01200
   98    73    74    37.50000  110.70000
   98    73    80    58.35000  112.70000
   98    96    97    37.50000  110.70000
   98   103   104    55.00000  108.50000
  103    98    99    35.00000  109.50000
  100    96    97    35.00000  109.50000
  100    96    98    80.00000  111.20000
  100   105   106    35.00000  109.50000
  100   105   107    35.00000  109.50000
  100   105   108    35.00000  109.50000
  102   100   101    35.00000  109.50000
  105   100   101    35.00000  109.50000
  105   100   102    35.00000  109.50000
  107   105   106    33.00000  107.80000
  108   105   106    33.00000  107.80000
  108   105   107    33.00000  107.80000
   93    86    87    50.00000  110.79000
   93    86    90    80.00000  112.76400
   95    93    94    40.00000  106.77200
   88    80    81    35.00000  109.50000
   88    80    86    50.00000  109.50000
   68    57    60    92.60000  111.55000
   68    64    65    35.00000  109.50000
   68    64    66    90.00000  109.38000
   61    41    42    35.00000  109.50000
   61    41    47    50.00000  109.50000
   61    57    60    92.60000  111.55000
   61    57    68    92.60000  111.55000
   58    53    54    35.00000  109.50000
   58    53    57    90.00000  111.58700
   55    49    50    35.00000  109.50000
   55    49    53    50.00000  109.50000
   51    47    48    35.00000  109.50000
   51    47    49    50.00000  109.50000
   43    39    40    35.00000  109.50000
   43    39    41    80.00000  111.20000
   45    43    44    35.00000  109.50000
   46    43    44    35.00000  109.50000
   46    43    45    35.00000  109.50000
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
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
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   90    96   -98    73   0.20000  1.0 3.0
   90    96    98    99   0.15000  1.0 3.0
   90    96    98   103   0.86500  1.0 1.0
   90    96    98   103  -0.17500 -1.0 2.0
   90    96    98   103   0.20800  1.0 3.0
   90    96   100   101   0.17350  1.0 3.0
   90    96   100   102   0.17350  1.0 3.0
   90    96   100   105   0.47100  1.0 1.0
   91    90    96    97   0.15000  1.0 3.0
   91    90    96    98   0.15000  1.0 3.0
   91    90    96   100   0.19200  1.0 3.0
   92    90    96    97   0.15000  1.0 3.0
   92    90    96    98   0.15000  1.0 3.0
   92    90    96   100   0.19200  1.0 3.0
   96    98   103   104  -0.11600  1.0 1.0
   96    98   103   104  -0.09450 -1.0 2.0
   96    98   103   104   0.21250  1.0 3.0
   96   100   105   106   0.15000  1.0 3.0
   96   100   105   107   0.15000  1.0 3.0
   96   100   105   108   0.15000  1.0 3.0
   97    96    98    73   0.15000  1.0 3.0
   97    96    98    99   0.15000  1.0 3.0
   97    96    98   103   0.23400  1.0 3.0
   97    96   100   101   0.13050  1.0 3.0
   97    96   100   102   0.13050  1.0 3.0
   97    96   100   105   0.15000  1.0 3.0
   98    73    80    81   0.15000  1.0 3.0
   98    73   -80    86   0.56750  1.0 1.0
   98    73   -80    86  -0.07550 -1.0 2.0
   98    73   -80    86   0.20000  1.0 3.0
   98    73    80    88   0.86500  1.0 1.0
   98    73    80    88  -0.17500 -1.0 2.0
   98    73    80    88   0.20800  1.0 3.0
   98    96   100   101   0.17350  1.0 3.0
   98    96   100   102   0.17350  1.0 3.0
   98    96   100   105   0.47100  1.0 1.0
   99    98   103   104   0.19450  1.0 3.0
  100    96    98    73   1.36600  1.0 1.0
  100    96    98    73  -0.11450 -1.0 2.0
  100    96    98    73   0.24250  1.0 3.0
  100    96    98    99   0.19200  1.0 3.0
  100    96    98   103   1.69300  1.0 1.0
  100    96    98   103  -0.48450 -1.0 2.0
  101   100   105   106   0.13050  1.0 3.0
  101   100   105   107   0.13050  1.0 3.0
  101   100   105   108   0.13050  1.0 3.0
  102   100   105   106   0.13050  1.0 3.0
  102   100   105   107   0.13050  1.0 3.0
  102   100   105   108   0.13050  1.0 3.0
   93    86    90    91   0.15000  1.0 3.0
   93    86    90    92   0.15000  1.0 3.0
   93    86    90    96   1.85550  1.0 1.0
   93    86    90    96  -0.84100 -1.0 2.0
   88    80    86    87   0.23400  1.0 3.0
   88    80    86    90   0.86500  1.0 1.0
   88    80    86    90  -0.17500 -1.0 2.0
   88    80    86    90   0.20800  1.0 3.0
   88    80    86    93   5.28650  1.0 1.0
   68    57   -60    62  -0.53350  1.0 1.0
   68    57   -60    62  -0.78350 -1.0 2.0
   68    57   -60    62   0.33750  1.0 3.0
   68    57    61    41  -0.53350  1.0 1.0
   68    57    61    41  -0.78350 -1.0 2.0
   68    57    61    41   0.33750  1.0 3.0
   68    64    66    67   0.23400  1.0 3.0
   68    64    66    69   1.11900  1.0 1.0
   68    64    66    69  -1.16350 -1.0 2.0
   68    64    66    69  -0.34150  1.0 3.0
   68    64    66    70   1.11900  1.0 1.0
   68    64    66    70  -1.16350 -1.0 2.0
   68    64    66    70  -0.34150  1.0 3.0
   61    41    47    48   0.23400  1.0 3.0
   61    41   -47    49   0.62750  1.0 1.0
   61    41   -47    49  -0.30950 -1.0 2.0
   61    41   -47    49   0.27300  1.0 3.0
   61    41    47    51   3.69350  1.0 1.0
   61    41    47    51  -1.82950 -1.0 2.0
   61    57    60    62  -0.53350  1.0 1.0
   61    57    60    62  -0.78350 -1.0 2.0
   61    57    60    62   0.33750  1.0 3.0
   61    57    68    64  -0.53350  1.0 1.0
   61    57    68    64  -0.78350 -1.0 2.0
   61    57    68    64   0.33750  1.0 3.0
   58    53    57    60   3.69350  1.0 1.0
   58    53    57    60  -1.82950 -1.0 2.0
   58    53    57    68   3.69350  1.0 1.0
   58    53    57    68  -1.82950 -1.0 2.0
   58    53    57    61   3.69350  1.0 1.0
   58    53    57    61  -1.82950 -1.0 2.0
   55    49    53    54   0.23400  1.0 3.0
   55    49    53    57   0.86500  1.0 1.0
   55    49    53    57  -0.17500 -1.0 2.0
   55    49    53    57   0.20800  1.0 3.0
   55    49    53    58   3.75450  1.0 1.0
   51    47    49    50   0.23400  1.0 3.0
   51    47    49    53   0.86500  1.0 1.0
   51    47    49    53  -0.17500 -1.0 2.0
   51    47    49    53   0.20800  1.0 3.0
   51    47    49    55   3.75450  1.0 1.0
   43    39    41    42   0.19200  1.0 3.0
   43    39    41    47   1.36600  1.0 1.0
   43    39    41    47  -0.11450 -1.0 2.0
   43    39    41    47   0.24250  1.0 3.0
   43    39    41    61   1.69300  1.0 1.0
   43    39    41    61  -0.48450 -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
   37    30    36    38  10.50000 -1.0 2.0
END
