* LIGAND DATABASE FILE (OPLS2005)
*
001     101   105    200    330     603
    1     0 S   NP   _N1_     1    28.25434    95.50013   -25.42197
    2     1 S   H    _HN1     2     1.02775   116.13970  -108.21812
    3     1 S   H    _H1_     3     1.02957    81.47462    -1.90557
    4     1 S   H    _H2_     4     1.02835    25.62132   175.17631
    5     1 S   CT   _CA1     5     1.50149   122.81144   106.89820
    6     5 S   HC   _HA1     6     1.09576   105.19727    84.64777
    7     5 S   CO3  _C1_     7     1.53776   112.31983   -35.51433
    8     7 S   O2Z  _O11     8     1.26370   114.98887   -44.23889
    9     7 S   O2Z  _O12     9     1.26232   114.93038   134.73728
   10     5 S   CT   _CB1    10     1.53087   107.40305  -157.46210
   11    10 S   HC   HB11    11     1.09831   109.30457   -50.27038
   12    10 S   HC   HB12    12     1.09816   110.44392    66.27189
   13    10 S   CT   _CG1    13     1.53036   112.70312  -171.31791
   14    13 S   HC   HG11    14     1.09591   110.53229   -65.15895
   15    13 S   HC   HG12    15     1.09660   109.88743    54.05997
   16    13 S   C    _CD1    16     1.51855   112.22984   174.41728
   17    16 S   O    _OE1    17     1.22771   123.25789     2.61748
   18    16 S   N    _N2_    18     1.38550   111.79091  -177.38596
   19    18 S   H    _HN2    19     1.01579   119.15263     3.58059
   20    18 S   CT1  _CA2    20     1.45839   122.80474   177.86834
   21    20 S   HC   _HA2    21     1.09739   108.82458    26.52614
   22    20 S   C    _C2_    22     1.52950   107.08079   -90.49717
   23    22 S   O    _O2_    23     1.22983   123.07590   -27.19926
   24    20 S   CT   _CB2    32     1.53151   112.21888   149.67250
   25    24 S   HC   HB21    33     1.09495   110.13550    54.67163
   26    24 S   HC   HB22    34     1.09459   110.07201   173.21048
   27    22 S   N    _N3_    24     1.38520   112.56839   155.39895
   28    27 S   H    _HN3    25     1.01662   120.34021    -1.48464
   29    24 S   S    _SG2    35     1.82746   110.97655   -66.76002
   30    27 S   CT   _CA3    26     1.45353   122.45203   178.79082
   31    30 S   HC   HA31    27     1.09566   107.70499   -58.31304
   32    30 S   HC   HA32    28     1.09567   107.69208    57.99408
   33    29 S   CT   _C11    36     1.86483    99.73034   177.92604
   34    33 S   HC   _H4_    37     1.09364   105.50848    30.33908
   35    30 S   CO3  _C3_    29     1.52889   114.38246   179.88636
   36    35 S   O2Z  _O31    30     1.26333   116.08207     1.09110
   37    35 S   O2Z  _O32    31     1.26448   114.39976  -178.93762
   38    33 S   CO4  _C12    38     1.54115   107.97412   -79.89151
   39    38 S   O    _O33    39     1.22838   124.49958    13.94463
   40    38 S   OS   _O34    40     1.35786   115.20637  -174.55281
   41    40 S   CT   _C13    41     1.44823   121.17480    43.00518
   42    41 S   HC   _H5_    42     1.09917   105.15249    71.03466
   43    41 S   C5BC _C14    43     1.50986   109.09327  -176.61043
   44    41 S   CT   _C5_    51     1.57805   112.03550   -48.25289
   45    43 S   C5BC _C15    44     1.42605   127.99107    35.77898
   46    45 S   HA   _H15    45     1.08085   127.35579     0.92936
   47    44 S   CT   _C6_    52     1.57459   108.77172   174.03626
   48    47 S   HC   _H11    53     1.09790   109.29172    86.14927
   49    47 S   HC   _H12    54     1.09793   110.41482   -29.14168
   50    44 S   CT   _C4_    98     1.56456   106.59781   -66.74880
   51    50 S   HC   _H8_    99     1.09560   111.89509    39.28657
   52    50 S   HC   _H9_   100     1.09549   111.41612   -80.22787
   53    50 S   HC   _H10   101     1.08958   114.06632   158.49079
   54    45 S   C5A  _C16    46     1.37435   106.69994  -179.14797
   55    54 S   HA   _H16    47     1.08020   133.82091  -179.76930
   56    47 S   CT   _C7_    55     1.53973   116.45934  -150.75629
   57    56 S   HC   _H13    56     1.09473   110.06330    93.15938
   58    56 S   HC   _H14    57     1.09123   106.94612  -151.78578
   59    54 S   OA   _O35    48     1.35640   110.47153     0.56958
   60    56 S   CT   _C8_    58     1.51940   110.54610   -29.86829
   61    60 S   HC   _H3_    59     1.09406   101.47484   -44.68717
   62    43 S   C5A  _C17    49     1.38221   127.08074  -142.13128
   63    62 S   HA   _H17    50     1.08069   133.38153    -0.92598
   64    60 S   CT   _C9_    60     1.61510   111.69317    67.43181
   65    64 S   CO4  _C18    61     1.57088   103.43992  -165.08407
   66    65 S   O    _O37    62     1.22935   124.13336   128.03575
   67    33 S   CT   _C10    92     1.57682   115.88750   150.68878
   68    67 S   OM   _O36    93     1.33639   105.92774    64.13294
   69    64 S   CT   _C29    94     1.56491   112.74339    82.73362
   70    69 S   HC   _H31    95     1.09412   111.87849   -43.97110
   71    69 S   HC   _H32    96     1.09310   112.19258  -164.37793
   72    69 S   HC   _H33    97     1.08807   114.29466    79.23926
   73    65 S   CT   _C19    63     1.53879   117.60053   -51.76212
   74    73 S   HC   _H18    64     1.09658   107.84488   174.57689
   75    73 S   HC   _H19    65     1.09058   111.10311   -68.84297
   76    73 S   CT   _C20    66     1.51254   107.66837    56.25733
   77    76 S   HC   _H6_    67     1.10507   103.25937    54.34562
   78    60 S   CT   _C21    68     1.57472   118.61744  -153.46759
   79    78 S   CT   _C22    69     1.56220   116.74736    58.98688
   80    79 S   HC   _H7_    70     1.09791   109.51305    37.80331
   81    78 S   CT   _C28    87     1.54926   115.81294   -70.19309
   82    81 S   HC   _H28    88     1.08797   113.15412   -78.33350
   83    81 S   HC   _H29    89     1.09397   111.78716   163.23364
   84    79 S   OS   _O38    71     1.46544   103.87960   151.76969
   85    79 S   CT   _C26    81     1.52901   118.76170   -89.91378
   86    85 S   HC   _H26    82     1.09246   111.08090    43.73070
   87    85 S   HC   _H27    83     1.09723   110.22482   -75.51341
   88    81 S   OH   _O41    90     1.42040   111.53707    44.45020
   89    88 S   HO   _H30    91     0.97210   107.25340   179.18219
   90    76 S   CT   _C23    72     1.52561   121.97384   170.27288
   91    85 S   CO3  _C27    84     1.53554   115.67393   164.49315
   92    91 S   O2Z  _O40    85     1.26089   117.06998    -4.35784
   93    91 S   O2Z  _O39    86     1.26616   113.88792   175.97586
   94    90 S   CT   _C24    73     1.52825   115.48009    38.22765
   95    94 S   HC   _H20    74     1.09632   110.48247   172.94832
   96    94 S   HC   _H21    75     1.09107   112.88277    54.68044
   97    94 S   HC   _H22    76     1.09507   111.40798   -66.73632
   98    90 S   CT   _C25    77     1.53471   111.54923   -86.13845
   99    98 S   HC   _H23    78     1.09622   110.75639  -175.58696
  100    98 S   HC   _H24    79     1.09470   111.58465    63.39308
  101    98 S   HC   _H25    80     1.09618   111.22990   -58.06113
  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  19   7  15  15   7
   7   3   2  13   6   4   3   1   1   8   2   1   1   7   3   2
   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    79    81    67    69  
   58    60    61    64    78  
   60    61    64    78  
   62    63  
   61    64    65    66    73    76    77    78    79    80    84    90    85    81    82    83    88    67    68    69    70    71    72  
   64    65    76    78    79    81    67    69  
   63  
    0  
   65    66    73    74    75    76    78    79    81    67    68    69    70    71    72  
   66    73    74    75    76    77    78    90    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    79    84    90    94    98    81  
   75    76    77    78    90  
   76    77    78    90  
   77    78    79    80    84    90    94    95    96    97    98    99   100   101    85    81    82    83    88  
   78    79    84    90    94    98    81  
   79    80    84    90    94    98    85    86    87    91    81    82    83    88    89  
   80    84    90    94    98    85    86    87    91    92    93    81    82    83    88  
   84    90    85    86    87    91    81  
   82    83    88    89    84    85    90  
   83    88    89  
   88    89  
   90    94    95    96    97    98    99   100   101    85    86    87    91  
   86    87    91    92    93    90  
   87    91    92    93  
   91    92    93  
   89  
    0  
   94    95    96    97    98    99   100   101  
   92    93  
   93  
    0  
   95    96    97    98    99   100   101  
   96    97    98  
   97    98  
   98  
   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   0.107500   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   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   85   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   87   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   88   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   89   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   90   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   91   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   92   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   93   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   94   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.522
   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    90   268.000  1.529
   78    79   268.000  1.529
   78    81   268.000  1.529
   79    80   340.000  1.090
   79    84   320.000  1.410
   79    85   268.000  1.529
   84    90   320.000  1.410
   90    94   268.000  1.529
   90    98   268.000  1.529
   94    95   340.000  1.090
   94    96   340.000  1.090
   94    97   340.000  1.090
   98    99   340.000  1.090
   98   100   340.000  1.090
   98   101   340.000  1.090
   85    86   340.000  1.090
   85    87   340.000  1.090
   85    91   317.000  1.522
   91    92   656.000  1.250
   91    93   656.000  1.250
   81    82   340.000  1.090
   81    83   340.000  1.090
   81    88   320.000  1.410
   88    89   553.000  0.945
   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    79    58.35000  112.70000
   60    78    81    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    90    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    79    58.35000  112.70000
   76    78    81    58.35000  112.70000
   76    90    84    50.00000  109.50000
   76    90    94    58.35000  112.70000
   76    90    98    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    79    80    37.50000  110.70000
   78    79    84    50.00000  109.50000
   78    79    85    58.35000  112.70000
   78    81    82    37.50000  110.70000
   78    81    83    37.50000  110.70000
   78    81    88    50.00000  109.50000
   79    84    90    60.00000  109.50000
   79    85    86    37.50000  110.70000
   79    85    87    37.50000  110.70000
   79    85    91    70.00000  109.69300
   84    79    80    35.00000  109.50000
   84    90    94    50.00000  109.50000
   84    90    98    50.00000  109.50000
   90    76    77    37.50000  110.70000
   90    76    78    58.35000  112.70000
   90    94    95    37.50000  110.70000
   90    94    96    37.50000  110.70000
   90    94    97    37.50000  110.70000
   90    98    99    37.50000  110.70000
   90    98   100    37.50000  110.70000
   90    98   101    37.50000  110.70000
   96    94    95    33.00000  107.80000
   97    94    95    33.00000  107.80000
   97    94    96    33.00000  107.80000
   98    90    94    58.35000  112.70000
  100    98    99    33.00000  107.80000
  101    98    99    33.00000  107.80000
  101    98   100    33.00000  107.80000
   85    79    80    37.50000  110.70000
   85    79    84    50.00000  109.50000
   85    91    92    70.00000  117.00000
   85    91    93    70.00000  117.00000
   87    85    86    33.00000  107.80000
   91    85    86    35.00000  109.50000
   91    85    87    35.00000  109.50000
   93    91    92    80.00000  126.00000
   81    78    79    58.35000  112.70000
   81    88    89    55.00000  108.50000
   83    81    82    33.00000  107.80000
   88    81    82    35.00000  109.50000
   88    81    83    35.00000  109.50000
   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
   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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   86    85    91    93   0.00000  1.0 1.0
   87    85    91    92   0.00000  1.0 1.0
   87    85    91    93   0.00000  1.0 1.0
   81    78    79    80   0.15000  1.0 3.0
   81    78    79    84   0.62750  1.0 1.0
   81    78    79    84  -0.30950 -1.0 2.0
   81    78    79    84   0.27300  1.0 3.0
   81    78    79    85   0.56750  1.0 1.0
   81    78    79    85  -0.07550 -1.0 2.0
   81    78    79    85   0.20000  1.0 3.0
   82    81    88    89   0.19450  1.0 3.0
   83    81    88    89   0.19450  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
   92    85    91    93  10.50000 -1.0 2.0
END
