* LIGAND DATABASE FILE (OPLS2005)
*
001     106   109    203    335     618
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02035   102.97306    11.62471
    3     1 S   H    _H1_     3     1.02084    41.46306   115.30153
    4     1 S   H    _H2_     4     1.02161    72.18117   -94.13267
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    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     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04748   118.84952     8.59078
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08457   106.27517   -11.11459
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    33     1.08519   110.67109    58.72486
   26    24 S   HC   HB22    34     1.08519   110.01707   179.21765
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C20    36     1.87890    96.00927  -158.12129
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CT   _C17    37     1.64059   110.26568  -160.02587
   38    33 S   CT   _C19    54     1.63434   109.13210    74.81928
   39    33 S   CT   _C29    99     1.55418   102.23228   -42.93938
   40    39 S   HC   _H67   100     1.08212   109.52527    62.82649
   41    37 S   CO4  _C8_    38     1.57298   112.62676    34.67160
   42    41 S   O    _O27    39     1.23578   121.47272    41.49079
   43    38 S   CT   _C23    55     1.56067   115.86022    25.21832
   44    43 S   HC   _H53    56     1.07890   108.25145   -56.43700
   45    43 S   HC   _H54    57     1.07820   108.22702  -176.40724
   46    43 S   HC   _H55    58     1.07868   108.23248    63.56684
   47    38 S   CT   _C28    59     1.55451   112.56530   -94.13331
   48    47 S   HC   _H66    60     1.08711   107.36624   -31.09025
   49    37 S   CT   _C22    95     1.55711   111.25807   148.12015
   50    49 S   HC   _H50    96     1.07974   108.51113    59.87207
   51    49 S   HC   _H51    97     1.08035   108.47375   -60.17871
   52    49 S   HC   _H52    98     1.08073   108.49323   179.87489
   53    39 S   C    _C10   101     1.50141   110.02072  -174.54878
   54    53 S   O    _O29   102     1.22462   124.29654   -31.53669
   55    39 S   OH   _O38   105     1.40911   106.57547   -55.58394
   56    55 S   HO   _H72   106     0.97558   107.41579  -179.07592
   57    41 S   CT   _C11    40     1.52285   120.18505  -146.71247
   58    57 S   HC   _H41    41     1.10297   107.86129   156.36644
   59    57 S   HC   _H42    42     1.09841   109.44863   -88.23564
   60    47 S   C5BC _C7_    61     1.49883   111.40564  -154.55140
   61    47 S   OH   _O37    69     1.41743   107.63109    85.43130
   62    61 S   HO   _H71    70     0.97274   107.01077  -178.76901
   63    53 S   OH   _O35   103     1.35783   112.71448   146.12084
   64    63 S   HO   _H69   104     0.98095   115.17980  -177.69132
   65    57 S   CT   _C14    43     1.50900   110.28080    37.02736
   66    65 S   HC   _H47    44     1.09756   104.95885    56.47633
   67    60 S   C5BC _C4_    62     1.41583   126.97926   -89.43075
   68    67 S   HA   _H38    63     1.08034   127.85437    -0.10087
   69    65 S   CT   _C18    45     1.53843   113.10414   -59.53759
   70    67 S   C5A  _C5_    64     1.37577   106.10073   179.95577
   71    70 S   HA   _H39    65     1.08027   133.80351  -180.00000
   72    37 S   CT   _C15    46     1.57437   107.10660   -89.36655
   73    72 S   HC   _H48    47     1.11383   105.95877    46.01901
   74    70 S   OA   _O30    66     1.35955   110.54566    -0.02798
   75    69 S   CT   _C16    71     1.54888    97.13082  -173.15009
   76    75 S   HC   _H49    72     1.09920   110.03794   -72.33514
   77    69 S   CT   _C27    90     1.54515   114.43927   -58.11452
   78    77 S   HC   _H64    91     1.08409   109.12861    60.03032
   79    77 S   HC   _H65    92     1.08381   109.13426   -60.95748
   80    72 S   CT   _C12    48     1.53678   112.11790   -65.11648
   81    80 S   HC   _H43    49     1.10597   111.72647   -90.50158
   82    80 S   HC   _H44    50     1.10256   109.76120   153.88356
   83    60 S   C5A  _C6_    67     1.37478   126.86542    90.47342
   84    83 S   HA   _H40    68     1.08044   133.93677     0.11014
   85    75 S   OS   _O33    73     1.45353   104.62787    42.41041
   86    75 S   CT   _C26    83     1.52216   118.27071   162.29747
   87    86 S   HC   _H62    84     1.09336   109.11819   -73.57019
   88    86 S   HC   _H63    85     1.09360   109.12408    45.86479
   89    77 S   OH   _O36    93     1.41049   107.87230   179.50307
   90    89 S   HO   _H70    94     0.97431   107.36038  -180.00000
   91    80 S   CT   _C13    51     1.53097   114.17359    35.04362
   92    91 S   HC   _H45    52     1.09737   108.06426   150.90958
   93    91 S   HC   _H46    53     1.09695   108.29133   -95.38100
   94    65 S   CT   _C21    74     1.53281   120.63749   174.88687
   95    86 S   C    _C9_    86     1.50548   111.84150   166.11940
   96    95 S   O    _O28    87     1.22147   126.37357     0.55848
   97    94 S   CT   _C24    75     1.52904   115.55955    32.69986
   98    97 S   HC   _H56    76     1.08901   109.75193   179.96044
   99    97 S   HC   _H57    77     1.08816   109.74576    59.99018
  100    97 S   HC   _H58    78     1.08821   109.75879   -60.06235
  101    94 S   CT   _C25    79     1.53394   111.28484   -91.67542
  102   101 S   HC   _H59    80     1.08678   109.46552  -179.97202
  103   101 S   HC   _H60    81     1.08632   109.47385    60.03433
  104   101 S   HC   _H61    82     1.08597   109.48309   -60.02039
  105    95 S   OH   _O34    88     1.35791   109.87726  -179.51503
  106   105 S   HO   _H68    89     0.98082   111.88420  -179.92338
  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  13   5   4   3
  31   2   1   1  26  24  13   5  15   6  11   4   3   2  14   6
   8   3   2   1   5   3   2   1  12   5   4  10   4   1   1   1
  22   8   6   4  21   4   2  16   6   2  16   7   8   3   2   5
   4   3   1   1  13   7   4   3   1   1   2   1   1   8   3   2
   7   3   2   1   3   2   1   1   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    41    72    91    38    43    47    49    39    40    53    55  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    41    42    57    69    72    73    80    91    92    93    38    43    44    45    46    47    48    60    61    49    50    51    52    39    40    53    54    63    55    56  
   35    36  
   36  
    0  
   41    42    57    58    59    65    69    72    73    80    81    82    91    38    43    47    75    77    49    50    51    52    39    40    53    55  
   43    44    45    46    47    48    60    67    83    61    62    49    39    40    53    55    41    72    80    81    82    91    92    93  
   40    53    54    63    64    55    56    41    43    47    49    72    91  
   53    54    63    55    56  
   42    57    58    59    65    66    69    72    73    80    94    49    50    51    52  
   57    58    59    65    72    49  
   44    45    46    47    48    60    61    80    91    92    93  
   45    46    47    91  
   46    47    91  
   47    91  
   48    60    67    68    70    74    83    84    61    62    80    91    92    93  
   60    67    83    61    62    91  
   50    51    52    57    69    72    73    80  
   51    52    72  
   52    72  
   72  
   54    63    64    55    56  
   63    64    55  
   56    63  
    0  
   58    59    65    66    69    72    75    85    94    97   101    77  
   59    65    66    69    94  
   65    66    69    94  
   67    68    70    71    74    83    84    61    62    91  
   62    67    83    91  
    0  
   64  
    0  
   66    69    72    73    80    75    76    85    94    97    98    99   100   101   102   103   104    86    77    78    79    89  
   69    72    75    85    94    97   101    77  
   68    70    71    74    83    84  
   70    71    74    83  
   72    73    80    81    82    91    75    76    85    94    97   101    86    87    88    95    77    78    79    89    90  
   71    74    83    84  
   74    83  
   73    80    81    82    91    92    93    75    76    85    94    86    77    78    79    89  
   80    81    82    91    75    77  
   83    84  
   76    85    94    97   101    86    87    88    95    96   105    77    78    79    89    80  
   85    94    86    87    88    95    77  
   78    79    89    90    80    85    86    94  
   79    89    90  
   89    90  
   81    82    91    92    93  
   82    91    92    93  
   91    92    93  
   84  
    0  
   94    97    98    99   100   101   102   103   104    86    87    88    95  
   87    88    95    96   105   106    94  
   88    95    96   105  
   95    96   105  
   90  
    0  
   92    93  
   93  
    0  
   97    98    99   100   101   102   103   104  
   96   105   106  
  105   106  
   98    99   100   101   102   103   104  
   99   100   101  
  100   101  
  101  
  102   103   104  
  103   104  
  104  
    0  
  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   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   38   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   39   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.470000   1.6780   1.4800   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   3.5000   0.0660   0.320000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.7500   0.1050   0.520000   2.1120   1.8750   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.440000   1.9750   1.7500   0.001000000  -0.126889456
   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   59   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   60   3.5500   0.0760  -0.143000   2.0020   1.7750   0.001000000  -0.843144165
   61   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   62   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   63   3.0000   0.1700  -0.530000   1.7660   1.5600   0.021068034  -0.322181743
   64   0.5000   0.0300   0.450000   0.9960   0.8600   0.030040813  -0.651083722
   65   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5500   0.0760  -0.154000   2.0020   1.7750   0.001000000  -0.843144165
   68   2.4200   0.0300   0.126000   1.3810   1.2100   0.030040813   0.268726247
   69   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   70   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   71   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   72   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.9000   0.1400  -0.190000   1.6450   1.4500   0.001000000  -0.126889456
   75   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   0.030000   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   84   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   85   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   90   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   91   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   95   3.7500   0.1050   0.520000   2.1120   1.8750   0.001000000  -0.126889456
   96   2.9600   0.2100  -0.440000   1.9750   1.7500   0.001000000  -0.126889456
   97   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  101   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  102   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   3.0000   0.1700  -0.530000   1.7660   1.5600   0.021068034  -0.322181743
  106   0.5000   0.0300   0.450000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   268.000  1.529
   33    38   268.000  1.529
   33    39   268.000  1.529
   37    41   317.000  1.522
   37    72   268.000  1.529
   37    49   268.000  1.529
   41    42   570.000  1.229
   41    57   317.000  1.522
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    65   268.000  1.529
   65    66   340.000  1.090
   65    69   268.000  1.529
   65    94   268.000  1.529
   69    72   268.000  1.529
   69    75   268.000  1.529
   69    77   268.000  1.529
   72    73   340.000  1.090
   72    80   268.000  1.529
   80    81   340.000  1.090
   80    82   340.000  1.090
   80    91   268.000  1.529
   91    92   340.000  1.090
   91    93   340.000  1.090
   91    38   268.000  1.529
   38    43   268.000  1.529
   38    47   268.000  1.529
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    46   340.000  1.090
   47    48   340.000  1.090
   47    60   285.000  1.502
   47    61   320.000  1.410
   60    67   469.000  1.424
   60    83   546.000  1.367
   67    68   367.000  1.080
   67    70   546.000  1.367
   70    71   367.000  1.080
   70    74   340.000  1.360
   74    83   340.000  1.360
   83    84   367.000  1.080
   61    62   553.000  0.945
   75    76   340.000  1.090
   75    85   320.000  1.410
   75    86   268.000  1.529
   85    94   320.000  1.410
   94    97   268.000  1.529
   94   101   268.000  1.529
   97    98   340.000  1.090
   97    99   340.000  1.090
   97   100   340.000  1.090
  101   102   340.000  1.090
  101   103   340.000  1.090
  101   104   340.000  1.090
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    95   317.000  1.522
   95    96   570.000  1.229
   95   105   450.000  1.364
  105   106   553.000  0.945
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    89   320.000  1.410
   89    90   553.000  0.945
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   340.000  1.090
   39    40   340.000  1.090
   39    53   317.000  1.522
   39    55   320.000  1.410
   53    54   570.000  1.229
   53    63   450.000  1.364
   63    64   553.000  0.945
   55    56   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  111.63000
   29    33    38    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    41    63.00000  111.10000
   33    37    72    58.35000  112.70000
   33    37    49    58.35000  112.70000
   33    38    91    58.35000  112.70000
   33    38    43    58.35000  112.70000
   33    38    47    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    53    63.00000  111.10000
   33    39    55    50.00000  109.50000
   37    41    42    80.00000  120.40000
   37    41    57    70.00000  116.00000
   37    72    69    58.35000  112.70000
   37    72    73    37.50000  110.70000
   37    72    80    58.35000  112.70000
   37    49    50    37.50000  110.70000
   37    49    51    37.50000  110.70000
   37    49    52    37.50000  110.70000
   41    57    58    35.00000  109.50000
   41    57    59    35.00000  109.50000
   41    57    65    63.00000  111.10000
   57    41    42    80.00000  120.40000
   57    65    66    37.50000  110.70000
   57    65    69    58.35000  112.70000
   57    65    94    58.35000  112.70000
   59    57    58    33.00000  107.80000
   65    57    58    37.50000  110.70000
   65    57    59    37.50000  110.70000
   65    69    72    58.35000  112.70000
   65    69    75    58.35000  112.70000
   65    69    77    58.35000  112.70000
   65    94    85    50.00000  109.50000
   65    94    97    58.35000  112.70000
   65    94   101    58.35000  112.70000
   69    65    66    37.50000  110.70000
   69    72    73    37.50000  110.70000
   69    72    80    58.35000  112.70000
   69    75    76    37.50000  110.70000
   69    75    85    50.00000  109.50000
   69    75    86    58.35000  112.70000
   69    77    78    37.50000  110.70000
   69    77    79    37.50000  110.70000
   69    77    89    50.00000  109.50000
   72    37    41    63.00000  111.10000
   72    80    81    37.50000  110.70000
   72    80    82    37.50000  110.70000
   72    80    91    58.35000  112.70000
   80    72    73    37.50000  110.70000
   80    91    92    37.50000  110.70000
   80    91    93    37.50000  110.70000
   80    91    38    58.35000  112.70000
   82    80    81    33.00000  107.80000
   91    80    81    37.50000  110.70000
   91    80    82    37.50000  110.70000
   91    38    43    58.35000  112.70000
   91    38    47    58.35000  112.70000
   93    91    92    33.00000  107.80000
   38    33    37    58.35000  112.70000
   38    91    92    37.50000  110.70000
   38    91    93    37.50000  110.70000
   38    43    44    37.50000  110.70000
   38    43    45    37.50000  110.70000
   38    43    46    37.50000  110.70000
   38    47    48    37.50000  110.70000
   38    47    60    70.00000  112.17500
   38    47    61    50.00000  109.50000
   45    43    44    33.00000  107.80000
   46    43    44    33.00000  107.80000
   46    43    45    33.00000  107.80000
   47    38    43    58.35000  112.70000
   47    60    67    60.00000  130.00000
   47    60    83    60.00000  130.00000
   47    61    62    55.00000  108.50000
   60    47    48    35.00000  109.50000
   60    67    68    35.00000  127.50000
   60    67    70    70.00000  107.30000
   60    83    74    70.00000  110.60000
   60    83    84    35.00000  132.10000
   67    70    71    35.00000  132.10000
   67    70    74    70.00000  110.60000
   70    67    68    35.00000  125.70000
   70    74    83    70.00000  106.50000
   74    70    71    35.00000  113.40000
   74    83    84    35.00000  113.40000
   83    60    67    70.00000  107.30000
   61    47    48    35.00000  109.50000
   61    47    60    90.00000  112.51600
   75    69    72    58.35000  112.70000
   75    85    94    60.00000  109.50000
   75    86    87    37.50000  110.70000
   75    86    88    37.50000  110.70000
   75    86    95    63.00000  111.10000
   85    75    76    35.00000  109.50000
   85    94    97    50.00000  109.50000
   85    94   101    50.00000  109.50000
   94    65    66    37.50000  110.70000
   94    65    69    58.35000  112.70000
   94    97    98    37.50000  110.70000
   94    97    99    37.50000  110.70000
   94    97   100    37.50000  110.70000
   94   101   102    37.50000  110.70000
   94   101   103    37.50000  110.70000
   94   101   104    37.50000  110.70000
   99    97    98    33.00000  107.80000
  100    97    98    33.00000  107.80000
  100    97    99    33.00000  107.80000
  101    94    97    58.35000  112.70000
  103   101   102    33.00000  107.80000
  104   101   102    33.00000  107.80000
  104   101   103    33.00000  107.80000
   86    75    76    37.50000  110.70000
   86    75    85    50.00000  109.50000
   86    95    96    80.00000  120.40000
   86    95   105    70.00000  108.00000
   88    86    87    33.00000  107.80000
   95    86    87    35.00000  109.50000
   95    86    88    35.00000  109.50000
   95   105   106    35.00000  113.00000
  105    95    96   100.00000  123.32000
   77    69    72    58.35000  112.70000
   77    69    75    58.35000  112.70000
   77    89    90    55.00000  108.50000
   79    77    78    33.00000  107.80000
   89    77    78    35.00000  109.50000
   89    77    79    35.00000  109.50000
   49    37    41    63.00000  111.10000
   49    37    72    58.35000  112.70000
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    33.00000  107.80000
   39    33    37    58.35000  112.70000
   39    33    38    58.35000  112.70000
   39    53    54    80.00000  120.40000
   39    53    63    70.00000  108.00000
   39    55    56    55.00000  108.50000
   53    39    40    35.00000  109.50000
   53    63    64    35.00000  113.00000
   63    53    54   100.00000  123.32000
   55    39    40    35.00000  109.50000
   55    39    53    95.00000  109.52300
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
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
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   76    75    86    87   0.15000  1.0 3.0
   76    75    86    88   0.15000  1.0 3.0
   76    75    86    95  -0.11250  1.0 3.0
   85    75    86    87   0.23400  1.0 3.0
   85    75    86    88   0.23400  1.0 3.0
   85    75    86    95  -0.09450  1.0 1.0
   85    75    86    95  -1.12950 -1.0 2.0
   85    75    86    95   0.54000  1.0 3.0
   85    94    97    98   0.23400  1.0 3.0
   85    94    97    99   0.23400  1.0 3.0
   85    94    97   100   0.23400  1.0 3.0
   85    94   101   102   0.23400  1.0 3.0
   85    94   101   103   0.23400  1.0 3.0
   85    94   101   104   0.23400  1.0 3.0
   94    65    69    72   0.56750  1.0 1.0
   94    65    69    72  -0.07550 -1.0 2.0
   94    65    69    72   0.20000  1.0 3.0
   94    65   -69    75   0.56750  1.0 1.0
   94    65   -69    75  -0.07550 -1.0 2.0
   94    65   -69    75   0.20000  1.0 3.0
   94    65    69    77   0.56750  1.0 1.0
   94    65    69    77  -0.07550 -1.0 2.0
   94    65    69    77   0.20000  1.0 3.0
   97    94   101   102   0.15000  1.0 3.0
   97    94   101   103   0.15000  1.0 3.0
   97    94   101   104   0.15000  1.0 3.0
  101    94    97    98   0.15000  1.0 3.0
  101    94    97    99   0.15000  1.0 3.0
  101    94    97   100   0.15000  1.0 3.0
   86    75    85    94   0.06250  1.0 1.0
   86    75    85    94  -0.01100 -1.0 2.0
   86    75    85    94   0.28050  1.0 3.0
   86    95   105   106   1.50000  1.0 1.0
   86    95   105   106   2.45000 -1.0 2.0
   87    86    95    96   0.00000  1.0 1.0
   87    86    95   105   0.00000  1.0 1.0
   88    86    95    96   0.00000  1.0 1.0
   88    86    95   105   0.00000  1.0 1.0
   96    95   105   106   0.92200  1.0 1.0
   96    95   105   106   3.74100 -1.0 2.0
   77    69    72    37   0.56750  1.0 1.0
   77    69    72    37  -0.07550 -1.0 2.0
   77    69    72    37   0.20000  1.0 3.0
   77    69    72    73   0.15000  1.0 3.0
   77    69    72    80   0.56750  1.0 1.0
   77    69    72    80  -0.07550 -1.0 2.0
   77    69    72    80   0.20000  1.0 3.0
   77    69    75    76   0.15000  1.0 3.0
   77    69    75    85   0.62750  1.0 1.0
   77    69    75    85  -0.30950 -1.0 2.0
   77    69    75    85   0.27300  1.0 3.0
   77    69    75    86   0.56750  1.0 1.0
   77    69    75    86  -0.07550 -1.0 2.0
   77    69    75    86   0.20000  1.0 3.0
   78    77    89    90   0.19450  1.0 3.0
   79    77    89    90   0.19450  1.0 3.0
   49    37    41    42   0.30150 -1.0 2.0
   49    37    41    57   0.60050  1.0 1.0
   49    37    41    57   0.05600 -1.0 2.0
   49    37    41    57   0.26150  1.0 3.0
   49    37    72    69   0.56750  1.0 1.0
   49    37    72    69  -0.07550 -1.0 2.0
   49    37    72    69   0.20000  1.0 3.0
   49    37    72    73   0.15000  1.0 3.0
   49    37    72    80   0.56750  1.0 1.0
   49    37    72    80  -0.07550 -1.0 2.0
   49    37    72    80   0.20000  1.0 3.0
   39    33    37    41  -0.95700  1.0 1.0
   39    33    37    41  -0.18200 -1.0 2.0
   39    33    37    41   0.29450  1.0 3.0
   39    33    37    72   0.56750  1.0 1.0
   39    33    37    72  -0.07550 -1.0 2.0
   39    33    37    72   0.20000  1.0 3.0
   39    33    37    49   0.56750  1.0 1.0
   39    33    37    49  -0.07550 -1.0 2.0
   39    33    37    49   0.20000  1.0 3.0
   39    33    38    91   0.56750  1.0 1.0
   39    33    38    91  -0.07550 -1.0 2.0
   39    33    38    91   0.20000  1.0 3.0
   39    33    38    43   0.56750  1.0 1.0
   39    33    38    43  -0.07550 -1.0 2.0
   39    33    38    43   0.20000  1.0 3.0
   39    33    38    47   0.56750  1.0 1.0
   39    33    38    47  -0.07550 -1.0 2.0
   39    33    38    47   0.20000  1.0 3.0
   39    53    63    64   1.50000  1.0 1.0
   39    53    63    64   2.45000 -1.0 2.0
   40    39    53    54   0.00000  1.0 1.0
   40    39    53    63   0.00000  1.0 1.0
   40    39    55    56   0.19450  1.0 3.0
   53    39    55    56   0.91850  1.0 1.0
   53    39    55    56   0.57950  1.0 3.0
   54    53    63    64   0.92200  1.0 1.0
   54    53    63    64   3.74100 -1.0 2.0
   55    39    53    54   0.30150 -1.0 2.0
   55    39    53    63   2.24650  1.0 1.0
   55    39    53    63   0.70300 -1.0 2.0
   55    39    53    63   0.26850  1.0 3.0
IPHI
    9     5     7     8  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    34    35  10.50000 -1.0 2.0
   37    57    41    42  10.50000 -1.0 2.0
   67    83    60    47   4.00000 -1.0 2.0
   70    68    67    60   1.10000 -1.0 2.0
   74    71    70    67   1.10000 -1.0 2.0
   74    84    83    60   1.10000 -1.0 2.0
   86   105    95    96  10.50000 -1.0 2.0
   39    63    53    54  10.50000 -1.0 2.0
END
