* LIGAND DATABASE FILE (OPLS2005)
*
001     106   110    209    338     629
    1     0 S   NP   _N1_     1    29.06421    95.03099   -26.06258
    2     1 S   H    _HN1     2     1.02947    77.25034     6.76631
    3     1 S   H    _H1_     3     1.02826    30.15089  -164.83245
    4     1 S   H    _H2_     4     1.02794   122.69678   -97.05573
    5     1 S   CT   _CA1     5     1.50133   118.75661   113.24562
    6     5 S   HC   _HA1     6     1.09573   105.15934    91.34433
    7     5 S   CO3  _C1_     7     1.53770   112.48433   -28.85707
    8     7 S   O2Z  _O11     8     1.26377   115.00138   -41.82409
    9     7 S   O2Z  _O12     9     1.26237   114.94787   137.19953
   10     5 S   CT   _CB1    10     1.53062   107.40613  -150.67636
   11    10 S   HC   HB11    11     1.09841   109.32717   -49.28913
   12    10 S   HC   HB12    12     1.09810   110.46802    67.30426
   13    10 S   CT   _CG1    13     1.53021   112.65297  -170.22694
   14    13 S   HC   HG11    14     1.09569   110.72540   -67.36278
   15    13 S   HC   HG12    15     1.09669   109.70419    51.89036
   16    13 S   C    _CD1    16     1.51810   112.00837   172.36984
   17    16 S   O    _OE1    17     1.22757   123.18270    11.98599
   18    16 S   N    _N2_    18     1.38635   111.82869  -167.99034
   19    18 S   H    _HN2    19     1.01577   119.00771     1.00405
   20    18 S   CT1  _CA2    20     1.46232   123.41211   176.84793
   21    20 S   HC   _HA2    21     1.09739   109.28579     8.39910
   22    20 S   C    _C2_    22     1.53674   108.81350  -107.17017
   23    22 S   O    _O2_    23     1.23082   122.27210  -147.82210
   24    20 S   CT   _CB2    32     1.53305   111.58095   130.38075
   25    24 S   HC   HB21    33     1.09496   110.01515    57.43673
   26    24 S   HC   HB22    34     1.09480   110.02542   176.15274
   27    22 S   N    _N3_    24     1.38328   113.87183    39.64002
   28    27 S   H    _HN3    25     1.01538   119.63969    -3.02194
   29    24 S   S    _SG2    35     1.82822   111.46000   -64.13574
   30    27 S   CT   _CA3    26     1.45281   123.25495   177.26341
   31    30 S   HC   HA31    27     1.09548   107.49460   -65.20412
   32    30 S   HC   HA32    28     1.09556   108.01443    51.25073
   33    29 S   CT   _C18    36     1.86026    99.65841   177.71381
   34    33 S   HC   _H7_    37     1.09270   105.08708    29.61591
   35    30 S   CO3  _C3_    29     1.52970   114.06096   173.26690
   36    35 S   O2Z  _O31    30     1.26382   116.09338    -0.49178
   37    35 S   O2Z  _O32    31     1.26428   114.41371   179.56569
   38    33 S   CO4  _C17    38     1.53932   108.58771   -80.36564
   39    38 S   O    _O38    39     1.22838   124.41574    13.68367
   40    38 S   OS   _O37    40     1.35876   115.22124  -174.69566
   41    40 S   CT   _C16    41     1.45076   121.77276    41.25590
   42    41 S   HC   _H6_    42     1.09911   105.05203    72.87383
   43    41 S   C5BC _C24    43     1.50983   109.12162  -174.94545
   44    41 S   CT   _C15    51     1.57948   112.15360   -46.41225
   45    43 S   C5BC _C25    44     1.42616   127.93497    34.72989
   46    45 S   HA   _H22    45     1.08088   127.33734     0.93230
   47    44 S   CT   _C14    52     1.56869   109.32401   173.42499
   48    47 S   HC   _H15    53     1.09781   109.53305    87.94674
   49    47 S   HC   _H16    54     1.09777   110.42463   -27.58727
   50    44 S   CT   _C28   103     1.56385   106.40033   -67.99960
   51    50 S   HC   _H25   104     1.09537   111.95730    42.87714
   52    50 S   HC   _H26   105     1.09574   111.30903   -76.41261
   53    50 S   HC   _H27   106     1.08783   114.32913   163.00176
   54    45 S   C5A  _C26    46     1.37432   106.69453  -179.20746
   55    54 S   HA   _H23    47     1.08018   133.82326  -179.74666
   56    47 S   CT   _C13    55     1.53731   116.12361  -148.96719
   57    56 S   HC   _H13    56     1.09590   110.09458    90.85515
   58    56 S   HC   _H14    57     1.09075   106.66675  -156.05284
   59    54 S   OA   _O41    48     1.35642   110.47089     0.57675
   60    56 S   CT   _C12    58     1.53328   111.40831   -31.70097
   61    60 S   HC   _H5_    59     1.09201   104.22775   -43.43563
   62    43 S   C5A  _C27    49     1.38213   127.13201  -143.23181
   63    62 S   HA   _H24    50     1.08067   133.39766    -0.85134
   64    60 S   CT   _C20    60     1.59205   109.46553    68.50707
   65    64 S   CO4  _C21    61     1.54281   100.32503  -163.11363
   66    65 S   O    _O39    62     1.22897   124.62471   115.50071
   67    33 S   CT   _C19    97     1.57520   115.79139   149.93166
   68    67 S   OM   _O40    98     1.33658   105.73835    66.01220
   69    64 S   CT   _C23    99     1.56420   112.15766    83.36424
   70    69 S   HC   _H19   100     1.09560   111.73262   -51.05876
   71    69 S   HC   _H20   101     1.09301   112.03816  -172.03607
   72    69 S   HC   _H21   102     1.08731   114.76863    70.27907
   73    65 S   CT   _C22    63     1.51520   116.59616   -62.15988
   74    73 S   HC   _H17    64     1.09747   106.39886   178.30742
   75    73 S   HC   _H18    65     1.08982   108.66265   -69.05540
   76    73 S   CT   _C10    66     1.54426   113.79805    58.17494
   77    76 S   HC   _H4_    67     1.10078   102.97481    69.85126
   78    60 S   CT   _C11    68     1.61245   116.45262  -153.25906
   79    76 S   CT   _C9_    77     1.58639   109.88551  -178.81007
   80    78 S   CT   _C6_    69     1.60981   106.62832    57.79164
   81    80 S   HC   _H3_    70     1.09385   107.83509   -61.70499
   82    79 S   CT   _C30    78     1.54071   114.28090    51.71907
   83    82 S   HC   _H31    79     1.09756   110.24487   173.61285
   84    82 S   HC   _H32    80     1.09125   112.31106    56.23893
   85    82 S   HC   _H33    81     1.09382   112.74972   -66.68093
   86    79 S   CT   _C31    82     1.54564   111.08892   -68.76705
   87    86 S   HC   _H34    83     1.09640   110.72312  -168.85705
   88    86 S   HC   _H35    84     1.09446   112.11388    70.37174
   89    86 S   HC   _H36    85     1.09495   111.57056   -50.38920
   90    78 S   CT   _C29    93     1.54006   111.38314   -57.77386
   91    90 S   HC   _H28    94     1.09522   111.16727    50.76391
   92    90 S   HC   _H29    95     1.08638   113.63414   -70.43116
   93    90 S   HC   _H30    96     1.09299   112.29107   169.65369
   94    80 S   CT   _C7_    71     1.52953   118.72064  -180.00000
   95    94 S   HC   _H11    72     1.09681   110.79109  -174.76314
   96    94 S   HC   _H12    73     1.09507   112.18062    66.95822
   97    80 S   OS   _O34    86     1.45260   109.26085    56.36245
   98    94 S   CO4  _C8_    74     1.49284   111.15835   -55.85195
   99    98 S   O    _O35    75     1.22131   125.31710   -98.63579
  100    97 S   CO4  _C5_    87     1.36212   118.32339  -141.51580
  101   100 S   O    _O33    88     1.22288   126.51591    -1.42903
  102    98 S   OS   _O36    76     1.35332   108.82113    80.50720
  103   100 S   CT   _C4_    89     1.49812   109.37508   178.60801
  104   103 S   HC   _H8_    90     1.09290   109.82360   -59.62298
  105   103 S   HC   _H9_    91     1.09372   109.37251  -178.58930
  106   103 S   HC   _H10    92     1.09283   109.80616    62.25284
  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
  14   7   2   1   1   9   3   9  20   7  11  18   6   4  15   7
   6   7   3   2   1   4   2  12   5   4   2  23   8   1   1  15
  14   6   7   1   5   2   1   1  11   5   4  21   7  16  14  15
   7   9   4   3   2   5   3   2   1   5   2   1   1   7   5   4
   7   2   1   5   4   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    67    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    44    64    67    68  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    44    47    60    64    65    67    68    69    50  
   38    39    40    44    64    67    68  
   36    37  
   37  
    0  
   39    40    41    42    43    44    64    67    68  
   40    41    67  
   41    42    43    45    62    44    47    67    50  
   42    43    45    46    54    59    62    63    44    47    48    49    56    64    67    68    50    51    52    53  
   43    45    62    44    47    67    50  
   45    46    54    55    59    62    63    44    47    67    50  
   47    48    49    56    57    58    60    64    65    67    68    69    50    51    52    53    45    62  
   46    54    55    59    62    63  
   54    55    59    62  
   48    49    56    57    58    60    61    64    78    67    68    50    51    52    53  
   49    56    57    58    60    67    50  
   56    57    58    60    67    50  
   51    52    53    56    64    67    68  
   52    53    67  
   53    67  
   67  
   55    59    62    63  
   59    62  
   57    58    60    61    64    65    76    78    80    90    67    69  
   58    60    61    64    78  
   60    61    64    78  
   62    63  
   61    64    65    66    73    76    77    78    80    81    94    79    97    90    91    92    93    67    68    69    70    71    72  
   64    65    76    78    80    90    67    69  
   63  
    0  
   65    66    73    74    75    76    78    80    90    67    68    69    70    71    72  
   66    73    74    75    76    77    78    79    67    68    69    70    71    72  
   73    74    75    76    67    69  
   68    69    70    71    72    73    78  
   69  
   70    71    72    73    78  
   71    72  
   72  
    0  
   74    75    76    77    78    80   102    79    82    86    90  
   75    76    77    78    79  
   76    77    78    79  
   77    78    80    81    94    98   102    79    82    83    84    85    86    87    88    89    97    90    91    92    93  
   78    80   102    79    82    86    90  
   80    81    94    95    96    98   102    79    82    86    97   100    90    91    92    93  
   82    83    84    85    86    87    88    89    90    80    94    98    99   102  
   81    94    95    96    98    99   102    97   100   101   103    90    91    92    93  
   94    95    96    98    97   100    90  
   83    84    85    86    87    88    89    98   102  
   84    85    86   102  
   85    86   102  
   86   102  
   87    88    89    98   102  
   88    89   102  
   89   102  
  102  
   91    92    93    94    97  
   92    93  
   93  
    0  
   95    96    98    99   102    97   100  
   96    98    99   102    97  
   98    99   102    97  
  100   101   103   104   105   106    98  
   99   102  
  102  
  101   103   104   105   106  
  103   104   105   106  
    0  
  104   105   106  
  105   106  
  106  
    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   2.4200   0.0150   0.060000   1.3810   1.2100   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   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   39   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   40   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   41   3.5000   0.0660   0.335000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   43   3.5500   0.0760  -0.143000   2.0020   1.7750   0.001000000  -0.843144165
   44   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   45   3.5500   0.0760  -0.154000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.126000   1.3810   1.2100   0.030040813   0.268726247
   47   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   55   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   56   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.9000   0.1400  -0.190000   1.6450   1.4500   0.001000000  -0.126889456
   60   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   64   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   65   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   66   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   67   4.2000   0.3000  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   68   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   69   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   75   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   76   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   79   3.5000   0.0660   0.250000   1.9750   1.7500   0.005000000  -0.741685710
   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  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   95   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   96   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   97   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   98   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   99   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
  100   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
  101   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
  102   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
  103   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  104   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  105   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  106   2.4200   0.0150   0.060000   1.3810   1.2100   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  1.522
   33    67   268.000  1.529
   38    39   570.000  1.229
   38    40   214.000  1.327
   40    41   320.000  1.410
   41    42   340.000  1.090
   41    43   285.000  1.502
   41    44   268.000  1.529
   43    45   469.000  1.424
   43    62   546.000  1.367
   45    46   367.000  1.080
   45    54   546.000  1.367
   54    55   367.000  1.080
   54    59   340.000  1.360
   59    62   340.000  1.360
   62    63   367.000  1.080
   44    47   268.000  1.529
   44    67   268.000  1.529
   44    50   268.000  1.529
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    56   268.000  1.529
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    60   268.000  1.529
   60    61   340.000  1.090
   60    64   268.000  1.529
   60    78   268.000  1.529
   64    65   317.000  1.522
   64    67   268.000  1.529
   64    69   268.000  1.529
   65    66   570.000  1.229
   65    73   317.000  1.522
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    76   268.000  1.529
   76    77   340.000  1.090
   76    78   268.000  1.529
   76    79   268.000  1.529
   78    80   268.000  1.529
   78    90   268.000  1.529
   80    81   340.000  1.090
   80    94   268.000  1.529
   80    97   320.000  1.410
   94    95   340.000  1.090
   94    96   340.000  1.090
   94    98   317.000  1.522
   98    99   570.000  1.229
   98   102   214.000  1.327
  102    79   320.000  1.410
   79    82   268.000  1.529
   79    86   268.000  1.529
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    85   340.000  1.090
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    89   340.000  1.090
   97   100   214.000  1.327
  100   101   570.000  1.229
  100   103   317.000  1.522
  103   104   340.000  1.090
  103   105   340.000  1.090
  103   106   340.000  1.090
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    93   340.000  1.090
   67    68   570.000  1.307
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   340.000  1.090
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   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  110.18000
   29    33    67    75.00000  111.63000
   33    38    39    80.00000  120.40000
   33    38    40    81.00000  111.40000
   33    67    44    58.35000  112.70000
   33    67    64    58.35000  112.70000
   33    67    68    50.00000  109.50000
   38    33    34    35.00000  109.50000
   38    40    41    83.00000  116.90000
   40    38    39    83.00000  123.40000
   40    41    42    35.00000  109.50000
   40    41    43    85.00000  111.85700
   40    41    44    50.00000  109.50000
   41    43    45    60.00000  130.00000
   41    43    62    60.00000  130.00000
   41    44    47    58.35000  112.70000
   41    44    67    58.35000  112.70000
   41    44    50    58.35000  112.70000
   43    41    42    35.00000  109.50000
   43    45    46    35.00000  127.50000
   43    45    54    70.00000  107.30000
   43    62    59    70.00000  110.60000
   43    62    63    35.00000  132.10000
   45    54    55    35.00000  132.10000
   45    54    59    70.00000  110.60000
   54    45    46    35.00000  125.70000
   54    59    62    70.00000  106.50000
   59    54    55    35.00000  113.40000
   59    62    63    35.00000  113.40000
   62    43    45    70.00000  107.30000
   44    41    42    37.50000  110.70000
   44    41    43    70.00000  112.17500
   44    47    48    37.50000  110.70000
   44    47    49    37.50000  110.70000
   44    47    56    58.35000  112.70000
   44    67    64    58.35000  112.70000
   44    67    68    50.00000  109.50000
   44    50    51    37.50000  110.70000
   44    50    52    37.50000  110.70000
   44    50    53    37.50000  110.70000
   47    56    57    37.50000  110.70000
   47    56    58    37.50000  110.70000
   47    56    60    58.35000  112.70000
   49    47    48    33.00000  107.80000
   56    47    48    37.50000  110.70000
   56    47    49    37.50000  110.70000
   56    60    61    37.50000  110.70000
   56    60    64    58.35000  112.70000
   56    60    78    58.35000  112.70000
   58    56    57    33.00000  107.80000
   60    56    57    37.50000  110.70000
   60    56    58    37.50000  110.70000
   60    64    65    63.00000  111.10000
   60    64    67    58.35000  112.70000
   60    64    69    58.35000  112.70000
   60    78    76    58.35000  112.70000
   60    78    80    58.35000  112.70000
   60    78    90    58.35000  112.70000
   64    60    61    37.50000  110.70000
   64    65    66    80.00000  120.40000
   64    65    73    70.00000  116.00000
   64    67    68    50.00000  109.50000
   64    69    70    37.50000  110.70000
   64    69    71    37.50000  110.70000
   64    69    72    37.50000  110.70000
   65    73    74    35.00000  109.50000
   65    73    75    35.00000  109.50000
   65    73    76    63.00000  111.10000
   73    65    66    80.00000  120.40000
   73    76    77    37.50000  110.70000
   73    76    78    58.35000  112.70000
   73    76    79    58.35000  112.70000
   75    73    74    33.00000  107.80000
   76    73    74    37.50000  110.70000
   76    73    75    37.50000  110.70000
   76    78    80    58.35000  112.70000
   76    78    90    58.35000  112.70000
   76    79   102    50.00000  109.50000
   76    79    82    58.35000  112.70000
   76    79    86    58.35000  112.70000
   78    60    61    37.50000  110.70000
   78    60    64    58.35000  112.70000
   78    76    77    37.50000  110.70000
   78    80    81    37.50000  110.70000
   78    80    94    58.35000  112.70000
   78    80    97    50.00000  109.50000
   78    90    91    37.50000  110.70000
   78    90    92    37.50000  110.70000
   78    90    93    37.50000  110.70000
   80    94    95    37.50000  110.70000
   80    94    96    37.50000  110.70000
   80    94    98    63.00000  111.10000
   80    97   100    83.00000  116.90000
   94    80    81    37.50000  110.70000
   94    98    99    80.00000  120.40000
   94    98   102    81.00000  111.40000
   96    94    95    33.00000  107.80000
   98    94    95    35.00000  109.50000
   98    94    96    35.00000  109.50000
   98   102    79    83.00000  116.90000
  102    98    99    83.00000  123.40000
  102    79    82    50.00000  109.50000
  102    79    86    50.00000  109.50000
   79    76    77    37.50000  110.70000
   79    76    78    58.35000  112.70000
   79    82    83    37.50000  110.70000
   79    82    84    37.50000  110.70000
   79    82    85    37.50000  110.70000
   79    86    87    37.50000  110.70000
   79    86    88    37.50000  110.70000
   79    86    89    37.50000  110.70000
   84    82    83    33.00000  107.80000
   85    82    83    33.00000  107.80000
   85    82    84    33.00000  107.80000
   86    79    82    58.35000  112.70000
   88    86    87    33.00000  107.80000
   89    86    87    33.00000  107.80000
   89    86    88    33.00000  107.80000
   97    80    81    35.00000  109.50000
   97    80    94    50.00000  109.50000
   97   100   101    83.00000  123.40000
   97   100   103    81.00000  111.40000
  100   103   104    35.00000  109.50000
  100   103   105    35.00000  109.50000
  100   103   106    35.00000  109.50000
  103   100   101    80.00000  120.40000
  105   103   104    33.00000  107.80000
  106   103   104    33.00000  107.80000
  106   103   105    33.00000  107.80000
   90    78    80    58.35000  112.70000
   92    90    91    33.00000  107.80000
   93    90    91    33.00000  107.80000
   93    90    92    33.00000  107.80000
   67    33    34    37.50000  110.70000
   67    33    38    63.00000  111.10000
   67    44    47    58.35000  112.70000
   67    64    65    63.00000  111.10000
   69    64    65    63.00000  111.10000
   69    64    67    58.35000  112.70000
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    33.00000  107.80000
   50    44    47    58.35000  112.70000
   50    44    67    58.35000  112.70000
   52    50    51    33.00000  107.80000
   53    50    51    33.00000  107.80000
   53    50    52    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
   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
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
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   98   102    79    86  -0.47000 -1.0 2.0
   98   102    79    86   0.11750  1.0 3.0
   99    98   102    79   3.00000 -1.0 2.0
  102    79    82    83   0.23400  1.0 3.0
  102    79    82    84   0.23400  1.0 3.0
  102    79    82    85   0.23400  1.0 3.0
  102    79    86    87   0.23400  1.0 3.0
  102    79    86    88   0.23400  1.0 3.0
  102    79    86    89   0.23400  1.0 3.0
   79    76    78    60   0.56750  1.0 1.0
   79    76    78    60  -0.07550 -1.0 2.0
   79    76    78    60   0.20000  1.0 3.0
   79    76    78    80   0.56750  1.0 1.0
   79    76    78    80  -0.07550 -1.0 2.0
   79    76    78    80   0.20000  1.0 3.0
   79    76    78    90   0.56750  1.0 1.0
   79    76    78    90  -0.07550 -1.0 2.0
   79    76    78    90   0.20000  1.0 3.0
   82    79    86    87   0.15000  1.0 3.0
   82    79    86    88   0.15000  1.0 3.0
   82    79    86    89   0.15000  1.0 3.0
   86    79    82    83   0.15000  1.0 3.0
   86    79    82    84   0.15000  1.0 3.0
   86    79    82    85   0.15000  1.0 3.0
   97    80    94    95   0.23400  1.0 3.0
   97    80    94    96   0.23400  1.0 3.0
   97    80    94    98  -0.09450  1.0 1.0
   97    80    94    98  -1.12950 -1.0 2.0
   97    80    94    98   0.54000  1.0 3.0
   97   100   103   104   0.00000  1.0 1.0
   97   100   103   105   0.00000  1.0 1.0
   97   100   103   106   0.00000  1.0 1.0
  101   100   103   104   0.00000  1.0 1.0
  101   100   103   105   0.00000  1.0 1.0
  101   100   103   106   0.00000  1.0 1.0
   90    78    80    81   0.15000  1.0 3.0
   90    78    80    94   0.56750  1.0 1.0
   90    78    80    94  -0.07550 -1.0 2.0
   90    78    80    94   0.20000  1.0 3.0
   90    78    80    97   0.62750  1.0 1.0
   90    78    80    97  -0.30950 -1.0 2.0
   90    78    80    97   0.27300  1.0 3.0
   67    33    38    39   0.30150 -1.0 2.0
   67    33   -38    40   0.36750  1.0 3.0
   67    44    47    48   0.15000  1.0 3.0
   67    44    47    49   0.15000  1.0 3.0
   67    44   -47    56   0.56750  1.0 1.0
   67    44   -47    56  -0.07550 -1.0 2.0
   67    44   -47    56   0.20000  1.0 3.0
   67    44    50    51   0.15000  1.0 3.0
   67    44    50    52   0.15000  1.0 3.0
   67    44    50    53   0.15000  1.0 3.0
   67    64    65    66   0.30150 -1.0 2.0
   67    64    65    73   0.60050  1.0 1.0
   67    64    65    73   0.05600 -1.0 2.0
   67    64    65    73   0.26150  1.0 3.0
   67    64    69    70   0.15000  1.0 3.0
   67    64    69    71   0.15000  1.0 3.0
   67    64    69    72   0.15000  1.0 3.0
   69    64    65    66   0.30150 -1.0 2.0
   69    64    65    73   0.60050  1.0 1.0
   69    64    65    73   0.05600 -1.0 2.0
   69    64    65    73   0.26150  1.0 3.0
   69    64    67    33   0.56750  1.0 1.0
   69    64    67    33  -0.07550 -1.0 2.0
   69    64    67    33   0.20000  1.0 3.0
   69    64    67    44   0.56750  1.0 1.0
   69    64    67    44  -0.07550 -1.0 2.0
   69    64    67    44   0.20000  1.0 3.0
   69    64    67    68   0.62750  1.0 1.0
   69    64    67    68  -0.30950 -1.0 2.0
   69    64    67    68   0.27300  1.0 3.0
   50    44    47    48   0.15000  1.0 3.0
   50    44    47    49   0.15000  1.0 3.0
   50    44    47    56   0.56750  1.0 1.0
   50    44    47    56  -0.07550 -1.0 2.0
   50    44    47    56   0.20000  1.0 3.0
   50    44    67    33   0.56750  1.0 1.0
   50    44    67    33  -0.07550 -1.0 2.0
   50    44    67    33   0.20000  1.0 3.0
   50    44    67    64   0.56750  1.0 1.0
   50    44    67    64  -0.07550 -1.0 2.0
   50    44    67    64   0.20000  1.0 3.0
   50    44    67    68   0.62750  1.0 1.0
   50    44    67    68  -0.30950 -1.0 2.0
   50    44    67    68   0.27300  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    40    38    39  10.50000 -1.0 2.0
   45    62    43    41   4.00000 -1.0 2.0
   54    46    45    43   1.10000 -1.0 2.0
   59    55    54    45   1.10000 -1.0 2.0
   59    63    62    43   1.10000 -1.0 2.0
   64    73    65    66  10.50000 -1.0 2.0
   94   102    98    99  10.50000 -1.0 2.0
   97   103   100   101  10.50000 -1.0 2.0
END
