* LIGAND DATABASE FILE (OPLS2005)
*
001     101   105    200    330     603
    1     0 S   NP   _N1_     1    28.80631    99.29513   -24.48683
    2     1 S   H    _HN1     2     1.02836    48.03493   167.27130
    3     1 S   H    _H1_     3     1.02781   117.75622  -103.09297
    4     1 S   H    _H2_     4     1.02959    59.19961    -7.36700
    5     1 S   CT   _CA1     5     1.50148   129.63927    84.52091
    6     5 S   HC   _HA1     6     1.09577   105.19201   111.23739
    7     5 S   CO3  _C1_     7     1.53759   112.30203    -8.90894
    8     7 S   O2Z  _O11     8     1.26365   114.99209   -45.05775
    9     7 S   O2Z  _O12     9     1.26227   114.91948   133.85866
   10     5 S   CT   _CB1    10     1.53066   107.38885  -130.91934
   11    10 S   HC   HB11    11     1.09834   109.25696   -50.53890
   12    10 S   HC   HB12    12     1.09815   110.46310    65.97720
   13    10 S   CT   _CG1    13     1.53044   112.73295  -171.59473
   14    13 S   HC   HG11    14     1.09588   110.55241   -65.74026
   15    13 S   HC   HG12    15     1.09657   109.89210    53.51297
   16    13 S   C    _CD1    16     1.51829   112.13905   173.82226
   17    16 S   O    _OE1    17     1.22783   123.23345     3.31671
   18    16 S   N    _N2_    18     1.38571   111.88070  -176.62281
   19    18 S   H    _HN2    19     1.01596   119.26876     2.53760
   20    18 S   CT1  _CA2    20     1.45828   122.63871   177.60608
   21    20 S   HC   _HA2    21     1.09668   109.69216    24.80055
   22    20 S   C    _C2_    22     1.52676   104.74628   -92.88587
   23    22 S   O    _O2_    23     1.22995   122.57100   -76.56570
   24    20 S   CT   _CB2    32     1.53129   112.05358   147.94927
   25    24 S   HC   HB21    33     1.09450   110.62763    51.10696
   26    24 S   HC   HB22    34     1.09511   109.58846   170.24649
   27    22 S   N    _N3_    24     1.38386   112.95271    99.49389
   28    27 S   H    _HN3    25     1.01677   120.19978    -0.81853
   29    24 S   S    _SG2    35     1.82653   110.50893   -69.88431
   30    27 S   CT   _CA3    26     1.45293   122.63101  -179.05892
   31    30 S   HC   HA31    27     1.09566   107.93802   -52.06705
   32    30 S   HC   HA32    28     1.09556   107.50000    64.30238
   33    29 S   CT   _C11    36     1.87266   100.24895  -174.71680
   34    33 S   HC   _H4_    37     1.09375   104.29218    19.15966
   35    30 S   CO3  _C3_    29     1.52891   114.28672  -174.15450
   36    35 S   O2Z  _O31    30     1.26330   116.09090    -1.69235
   37    35 S   O2Z  _O32    31     1.26440   114.38766   178.34259
   38    33 S   CO3  _C12    38     1.57236    97.59248   -88.41627
   39    38 S   O2Z  _O34    39     1.26275   117.51090   -84.79775
   40    38 S   O2Z  _O33    40     1.27026   114.23022    94.97205
   41    33 S   CT   _C10    41     1.62393   118.19083   136.05896
   42    41 S   OM   _O35    42     1.32183   107.09303    73.53711
   43    41 S   CT   _C9_    43     1.66735   113.51828   -45.63930
   44    41 S   CT   _C5_    81     1.67796   109.29272  -169.60025
   45    43 S   CO4  _C13    44     1.57803   114.87157    59.24610
   46    45 S   O    _O36    45     1.23697   121.91085    44.52024
   47    44 S   CT   _C4_    82     1.56327   111.96461   -41.47755
   48    47 S   HC   _H8_    83     1.09390   112.25985   -54.71465
   49    47 S   HC   _H9_    84     1.09369   111.62826  -175.01061
   50    47 S   HC   _H10    85     1.09194   112.13628    68.34903
   51    44 S   CT   _C25    86     1.60151   114.82347  -161.51019
   52    51 S   HC   _H7_    87     1.08257   110.15549   -40.82726
   53    43 S   CT   _C24    98     1.56555   113.68121   172.04650
   54    53 S   HC   _H27    99     1.08931   113.88766    85.17145
   55    53 S   HC   _H28   100     1.09524   112.12780   -38.49483
   56    53 S   HC   _H29   101     1.09540   112.38595  -154.98866
   57    45 S   CT   _C14    46     1.52645   119.96775  -146.49005
   58    57 S   HC   _H15    47     1.09649   107.59252   153.34635
   59    57 S   HC   _H16    48     1.09319   108.30311   -90.75563
   60    51 S   C5BC _C26    88     1.50881   116.56201  -160.70543
   61    51 S   OH   _O41    96     1.43585   110.33746    74.25344
   62    61 S   HO   _H33    97     0.97163   107.42921  -166.35068
   63    57 S   CT   _C15    49     1.50780   111.31907    33.54138
   64    63 S   HC   _H5_    50     1.10169   104.64518    58.54102
   65    60 S   C5BC _C27    89     1.42587   128.31634   -85.58227
   66    65 S   HA   _H30    90     1.08086   127.38346     1.29483
   67    63 S   CT   _C16    51     1.53771   113.65162   -57.37326
   68    63 S   CT   _C21    64     1.52502   120.48452   175.32098
   69    65 S   C5A  _C28    91     1.37435   106.75668  -178.56878
   70    69 S   HA   _H31    92     1.08020   133.81512  -179.69417
   71    67 S   CT   _C17    52     1.54811   117.61198   -55.95293
   72    71 S   HC   _H17    53     1.09001   111.86534    32.48689
   73    71 S   HC   _H18    54     1.09350   111.65541   151.81184
   74    68 S   CT   _C22    65     1.53357   111.55184   -87.70467
   75    74 S   HC   _H21    66     1.09616   110.86238  -176.63152
   76    74 S   HC   _H22    67     1.09462   111.74198    62.15628
   77    74 S   HC   _H23    68     1.09552   110.83959   -59.28362
   78    68 S   CT   _C23    69     1.52807   115.42814    36.67740
   79    78 S   HC   _H24    70     1.09615   110.58055   170.14629
   80    78 S   HC   _H25    71     1.09059   112.67741    51.58552
   81    78 S   HC   _H26    72     1.09519   111.42057   -69.40280
   82    43 S   CT   _C8_    73     1.58573   106.28425   -65.35719
   83    82 S   HC   _H3_    74     1.09703   106.11316    51.10423
   84    69 S   OA   _O40    93     1.35620   110.46077     0.91707
   85    71 S   OS   _O37    55     1.44308   115.75282   -87.90607
   86    82 S   CT   _C7_    75     1.53551   111.74065   -61.24294
   87    86 S   HC   _H13    76     1.09066   112.56443   -64.53673
   88    86 S   HC   _H14    77     1.09420   109.49667   177.90389
   89    60 S   C5A  _C29    94     1.38285   126.80341    97.85801
   90    89 S   HA   _H32    95     1.08052   133.38886    -1.35826
   91    85 S   CO4  _C18    56     1.35445   119.56453   -51.75728
   92    91 S   O    _O38    57     1.22628   122.31671  -159.65498
   93    86 S   CT   _C6_    78     1.52458   111.78956    60.13613
   94    93 S   HC   _H11    79     1.09825   106.94744    66.54700
   95    93 S   HC   _H12    80     1.09607   108.81202   177.77287
   96    91 S   CT   _C19    58     1.50221   114.98972    20.55885
   97    96 S   HC   _H19    59     1.09639   107.08466   151.67386
   98    96 S   HC   _H20    60     1.09165   108.81520   -91.05862
   99    67 S   CT   _C20    61     1.53632    98.21855  -171.54028
  100    99 S   HC   _H6_    62     1.09667   111.59584   -81.63499
  101    99 S   OS   _O39    63     1.45458   106.66761    34.84238
  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   6   2   1  25   8  22  20  15   6  11   4
   3   2  14   6   8   3   2   1  12   5   4  10   4   1  22   8
   6   4  20  14   4   2  12   5   4   9   4   3   2   5   3   2
   1  12   5   2   6   6   4   3   1   1   7   4   2   1   1   5
   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    41    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    42    43    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    45    82    93    44    47    51    53  
   38    39    40    41    42    43    44  
   36    37  
   37  
    0  
   39    40    41    42    43    44  
   40    41  
   41  
   42    43    45    46    57    67    82    83    86    93    94    95    44    47    48    49    50    51    52    60    61    53    54    55    56  
   43    45    82    93    44    47    51    53  
   45    46    57    58    59    63    67    71    99    82    83    86    87    88    93    44    47    51    53    54    55    56  
   47    48    49    50    51    52    60    65    89    61    62    53    45    82    86    87    88    93    94    95  
   46    57    58    59    63    64    67    68    82    83    86    53    54    55    56  
   57    58    59    63    82    53  
   48    49    50    51    52    60    61    86    93    94    95  
   49    50    51    93  
   50    51    93  
   51    93  
   52    60    65    66    69    84    89    90    61    62    86    93    94    95  
   60    65    89    61    62    93  
   54    55    56    57    67    82    83    86  
   55    56    82  
   56    82  
   82  
   58    59    63    64    67    71    99   101    68    74    78    82  
   59    63    64    67    68  
   63    64    67    68  
   65    66    69    70    84    89    90    61    62    93  
   62    65    89    93  
    0  
   64    67    71    72    73    85    96    99   100   101    68    74    75    76    77    78    79    80    81    82    83    86  
   67    71    99   101    68    74    78    82  
   66    69    70    84    89    90  
   69    70    84    89  
   71    72    73    85    91    96    97    98    99   100   101    68    74    78    82    83    86    87    88    93  
   74    75    76    77    78    79    80    81    82    71    96    99   100   101  
   70    84    89    90  
   84    89  
   72    73    85    91    92    96    99   100   101    82    83    86  
   73    85    91    99    82  
   85    91    99    82  
   75    76    77    78    79    80    81    99   101  
   76    77    78   101  
   77    78   101  
   78   101  
   79    80    81    99   101  
   80    81   101  
   81   101  
  101  
   83    86    87    88    93    94    95    85    96    99   100   101  
   86    87    88    93    99  
   89    90  
   91    92    96    97    98    99  
   87    88    93    94    95    99  
   88    93    94    95  
   93    94    95  
   90  
    0  
   92    96    97    98    99   100   101  
   96    97    98    99  
   94    95  
   95  
    0  
   97    98    99   100   101  
   98    99   100   101  
   99   100   101  
  100   101  
  101  
    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   0.007500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   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   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   39   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   40   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   41   4.2000   0.3000  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   42   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   43   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   44   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   45   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   47   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660   0.320000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5500   0.0760  -0.154000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.126000   1.3810   1.2100   0.030040813   0.268726247
   67   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   68   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   69   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   70   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   71   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   73   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   74   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.9000   0.1400  -0.190000   1.6450   1.4500   0.001000000  -0.126889456
   85   3.0000   0.1700  -0.330000   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   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   90   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   91   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   92   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   93   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   98   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   99   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
  100   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  101   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
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    41   268.000  1.529
   38    39   656.000  1.250
   38    40   656.000  1.250
   41    42   570.000  1.307
   41    43   268.000  1.529
   41    44   268.000  1.529
   43    45   317.000  1.522
   43    82   268.000  1.529
   43    53   268.000  1.529
   45    46   570.000  1.229
   45    57   317.000  1.522
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    63   268.000  1.529
   63    64   340.000  1.090
   63    67   268.000  1.529
   63    68   268.000  1.529
   67    71   268.000  1.529
   67    99   268.000  1.529
   67    82   268.000  1.529
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    85   320.000  1.410
   85    91   214.000  1.327
   91    92   570.000  1.229
   91    96   317.000  1.522
   96    97   340.000  1.090
   96    98   340.000  1.090
   96    99   268.000  1.529
   99   100   340.000  1.090
   99   101   320.000  1.410
  101    68   320.000  1.410
   68    74   268.000  1.529
   68    78   268.000  1.529
   74    75   340.000  1.090
   74    76   340.000  1.090
   74    77   340.000  1.090
   78    79   340.000  1.090
   78    80   340.000  1.090
   78    81   340.000  1.090
   82    83   340.000  1.090
   82    86   268.000  1.529
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    93   268.000  1.529
   93    94   340.000  1.090
   93    95   340.000  1.090
   93    44   268.000  1.529
   44    47   268.000  1.529
   44    51   268.000  1.529
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    50   340.000  1.090
   51    52   340.000  1.090
   51    60   285.000  1.502
   51    61   320.000  1.410
   60    65   469.000  1.424
   60    89   546.000  1.367
   65    66   367.000  1.080
   65    69   546.000  1.367
   69    70   367.000  1.080
   69    84   340.000  1.360
   84    89   340.000  1.360
   89    90   367.000  1.080
   61    62   553.000  0.945
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   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    70.00000  116.78000
   29    33    41    75.00000  111.63000
   33    38    39    70.00000  117.00000
   33    38    40    70.00000  117.00000
   33    41    42    50.00000  109.50000
   33    41    43    58.35000  112.70000
   33    41    44    58.35000  112.70000
   38    33    34    35.00000  109.50000
   40    38    39    80.00000  126.00000
   41    33    34    37.50000  110.70000
   41    33    38    70.00000  109.69300
   41    43    45    63.00000  111.10000
   41    43    82    58.35000  112.70000
   41    43    53    58.35000  112.70000
   41    44    93    58.35000  112.70000
   41    44    47    58.35000  112.70000
   41    44    51    58.35000  112.70000
   43    41    42    50.00000  109.50000
   43    45    46    80.00000  120.40000
   43    45    57    70.00000  116.00000
   43    82    67    58.35000  112.70000
   43    82    83    37.50000  110.70000
   43    82    86    58.35000  112.70000
   43    53    54    37.50000  110.70000
   43    53    55    37.50000  110.70000
   43    53    56    37.50000  110.70000
   45    57    58    35.00000  109.50000
   45    57    59    35.00000  109.50000
   45    57    63    63.00000  111.10000
   57    45    46    80.00000  120.40000
   57    63    64    37.50000  110.70000
   57    63    67    58.35000  112.70000
   57    63    68    58.35000  112.70000
   59    57    58    33.00000  107.80000
   63    57    58    37.50000  110.70000
   63    57    59    37.50000  110.70000
   63    67    71    58.35000  112.70000
   63    67    99    58.35000  112.70000
   63    67    82    58.35000  112.70000
   63    68   101    50.00000  109.50000
   63    68    74    58.35000  112.70000
   63    68    78    58.35000  112.70000
   67    63    64    37.50000  110.70000
   67    71    72    37.50000  110.70000
   67    71    73    37.50000  110.70000
   67    71    85    50.00000  109.50000
   67    99    96    58.35000  112.70000
   67    99   100    37.50000  110.70000
   67    99   101    50.00000  109.50000
   67    82    83    37.50000  110.70000
   67    82    86    58.35000  112.70000
   71    85    91    83.00000  116.90000
   73    71    72    33.00000  107.80000
   85    71    72    35.00000  109.50000
   85    71    73    35.00000  109.50000
   85    91    92    83.00000  123.40000
   85    91    96    81.00000  111.40000
   91    96    97    35.00000  109.50000
   91    96    98    35.00000  109.50000
   91    96    99    63.00000  111.10000
   96    91    92    80.00000  120.40000
   96    99   100    37.50000  110.70000
   96    99   101    50.00000  109.50000
   98    96    97    33.00000  107.80000
   99    67    71    58.35000  112.70000
   99    96    97    37.50000  110.70000
   99    96    98    37.50000  110.70000
   99   101    68    60.00000  109.50000
  101    99   100    35.00000  109.50000
  101    68    74    50.00000  109.50000
  101    68    78    50.00000  109.50000
   68    63    64    37.50000  110.70000
   68    63    67    58.35000  112.70000
   68    74    75    37.50000  110.70000
   68    74    76    37.50000  110.70000
   68    74    77    37.50000  110.70000
   68    78    79    37.50000  110.70000
   68    78    80    37.50000  110.70000
   68    78    81    37.50000  110.70000
   76    74    75    33.00000  107.80000
   77    74    75    33.00000  107.80000
   77    74    76    33.00000  107.80000
   78    68    74    58.35000  112.70000
   80    78    79    33.00000  107.80000
   81    78    79    33.00000  107.80000
   81    78    80    33.00000  107.80000
   82    43    45    63.00000  111.10000
   82    67    71    58.35000  112.70000
   82    67    99    58.35000  112.70000
   82    86    87    37.50000  110.70000
   82    86    88    37.50000  110.70000
   82    86    93    58.35000  112.70000
   86    82    83    37.50000  110.70000
   86    93    94    37.50000  110.70000
   86    93    95    37.50000  110.70000
   86    93    44    58.35000  112.70000
   88    86    87    33.00000  107.80000
   93    86    87    37.50000  110.70000
   93    86    88    37.50000  110.70000
   93    44    47    58.35000  112.70000
   93    44    51    58.35000  112.70000
   95    93    94    33.00000  107.80000
   44    41    42    50.00000  109.50000
   44    41    43    58.35000  112.70000
   44    93    94    37.50000  110.70000
   44    93    95    37.50000  110.70000
   44    47    48    37.50000  110.70000
   44    47    49    37.50000  110.70000
   44    47    50    37.50000  110.70000
   44    51    52    37.50000  110.70000
   44    51    60    70.00000  112.17500
   44    51    61    50.00000  109.50000
   49    47    48    33.00000  107.80000
   50    47    48    33.00000  107.80000
   50    47    49    33.00000  107.80000
   51    44    47    58.35000  112.70000
   51    60    65    60.00000  130.00000
   51    60    89    60.00000  130.00000
   51    61    62    55.00000  108.50000
   60    51    52    35.00000  109.50000
   60    65    66    35.00000  127.50000
   60    65    69    70.00000  107.30000
   60    89    84    70.00000  110.60000
   60    89    90    35.00000  132.10000
   65    69    70    35.00000  132.10000
   65    69    84    70.00000  110.60000
   69    65    66    35.00000  125.70000
   69    84    89    70.00000  106.50000
   84    69    70    35.00000  113.40000
   84    89    90    35.00000  113.40000
   89    60    65    70.00000  107.30000
   61    51    52    35.00000  109.50000
   61    51    60    90.00000  112.51600
   53    43    45    63.00000  111.10000
   53    43    82    58.35000  112.70000
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    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
   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
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
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   44    41    43    53   0.56750  1.0 1.0
   44    41    43    53  -0.07550 -1.0 2.0
   44    41    43    53   0.20000  1.0 3.0
   44    51    60    65   0.04150 -1.0 2.0
   44    51    60    89   0.04150 -1.0 2.0
   44    51    61    62  -0.11600  1.0 1.0
   44    51    61    62  -0.09450 -1.0 2.0
   44    51    61    62   0.21250  1.0 3.0
   47    44    51    52   0.15000  1.0 3.0
   47    44    51    60  -0.03700  1.0 1.0
   47    44    51    60   0.37200 -1.0 2.0
   47    44    51    60  -0.47300  1.0 3.0
   47    44    51    61   0.86500  1.0 1.0
   47    44    51    61  -0.17500 -1.0 2.0
   47    44    51    61   0.20800  1.0 3.0
   51    44    47    48   0.15000  1.0 3.0
   51    44    47    49   0.15000  1.0 3.0
   51    44    47    50   0.15000  1.0 3.0
   51    60    65    66   3.62500 -1.0 2.0
   51    60    65    69   3.62500 -1.0 2.0
   51    60    89    84   3.62500 -1.0 2.0
   51    60    89    90   3.62500 -1.0 2.0
   52    51    60    65   0.00000  1.0 1.0
   52    51    60    89   0.00000  1.0 1.0
   52    51    61    62   0.19450  1.0 3.0
   60    51    61    62   0.31900  1.0 1.0
   60    51    61    62  -0.11800 -1.0 2.0
   60    51    61    62   0.38750  1.0 3.0
   60    65    69    70   3.62500 -1.0 2.0
   60    65   -69    84   3.62500 -1.0 2.0
   65    60   -89    84   3.62500 -1.0 2.0
   65    60    89    90   3.62500 -1.0 2.0
   65    69   -84    89   3.62500 -1.0 2.0
   66    65    69    70   3.62500 -1.0 2.0
   66    65    69    84   3.62500 -1.0 2.0
   69    84   -89    60   3.62500 -1.0 2.0
   69    84    89    90   3.62500 -1.0 2.0
   70    69    84    89   3.62500 -1.0 2.0
   89    60    65    66   3.62500 -1.0 2.0
   89    60   -65    69   3.62500 -1.0 2.0
   61    51    60    65   0.14300 -1.0 2.0
   61    51    60    65   0.00300  1.0 3.0
   61    51    60    89   0.14300 -1.0 2.0
   61    51    60    89   0.00300  1.0 3.0
   53    43    45    46   0.30150 -1.0 2.0
   53    43    45    57   0.60050  1.0 1.0
   53    43    45    57   0.05600 -1.0 2.0
   53    43    45    57   0.26150  1.0 3.0
   53    43    82    67   0.56750  1.0 1.0
   53    43    82    67  -0.07550 -1.0 2.0
   53    43    82    67   0.20000  1.0 3.0
   53    43    82    83   0.15000  1.0 3.0
   53    43    82    86   0.56750  1.0 1.0
   53    43    82    86  -0.07550 -1.0 2.0
   53    43    82    86   0.20000  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   39    33    38    40  10.50000 -1.0 2.0
   43    57    45    46  10.50000 -1.0 2.0
   85    96    91    92  10.50000 -1.0 2.0
   65    89    60    51   4.00000 -1.0 2.0
   69    66    65    60   1.10000 -1.0 2.0
   84    70    69    65   1.10000 -1.0 2.0
   84    90    89    60   1.10000 -1.0 2.0
END
