* LIGAND DATABASE FILE (OPLS2005)
*
001     114   116    210    322     606
    1     0 S   NP   _N1_     1    28.51088    91.72361   -22.54073
    2     1 S   H    _HN1     2     1.02779    95.40948   -96.92956
    3     1 S   H    _H1_     3     1.02953   103.59667    13.40158
    4     1 S   H    _H2_     4     1.02844    15.44842   118.61183
    5     1 S   CT   _CA1     5     1.50043   125.15792   141.01700
    6     5 S   HC   _HA1     6     1.09490   105.30892    53.50609
    7     5 S   CO3  _C1_     7     1.53794   112.07314   -66.85898
    8     7 S   O2Z  _O11     8     1.26363   114.97358   -50.16611
    9     7 S   O2Z  _O12     9     1.26212   114.96570   128.94398
   10     5 S   CT   _CB1    10     1.53115   107.59222   171.31183
   11    10 S   HC   HB11    11     1.09821   109.66178   -49.29867
   12    10 S   HC   HB12    12     1.09808   110.38924    67.38936
   13    10 S   CT   _CG1    13     1.53047   112.38079  -170.20899
   14    13 S   HC   HG11    14     1.09606   110.46061   -59.11808
   15    13 S   HC   HG12    15     1.09643   109.96589    60.01457
   16    13 S   C    _CD1    16     1.51823   112.34731  -179.35048
   17    16 S   O    _OE1    17     1.22717   123.26615    -1.89259
   18    16 S   N    _N2_    18     1.38656   111.63724   177.75650
   19    18 S   H    _HN2    19     1.01576   119.01323     3.21248
   20    18 S   CT1  _CA2    20     1.46284   123.40873  -176.71282
   21    20 S   HC   _HA2    21     1.09726   109.41532    -5.75340
   22    20 S   C    _C2_    22     1.53372   108.61045  -121.66585
   23    22 S   O    _O2_    23     1.23028   122.13354  -145.30784
   24    20 S   CT   _CB2    32     1.53509   111.25354   116.03689
   25    24 S   HC   HB21    33     1.09592   109.60574    57.89440
   26    24 S   HC   HB22    34     1.09478   110.51259   176.84880
   27    22 S   N    _N3_    24     1.38471   113.46348    41.97286
   28    27 S   H    _HN3    25     1.01517   118.95293    -0.57675
   29    24 S   S    _SG2    35     1.82733   111.46212   -62.88242
   30    27 S   CT   _CA3    26     1.45460   123.49962   175.19282
   31    30 S   HC   HA31    27     1.09517   109.32709    22.81204
   32    30 S   HC   HA32    28     1.09498   107.10525   139.82442
   33    29 S   CT   _C27    36     1.83722    99.71196   165.59697
   34    33 S   HC   _H6_    37     1.09615   107.94557   -37.17669
   35    30 S   CO3  _C3_    29     1.52917   113.02548  -100.72761
   36    35 S   O2Z  _O31    30     1.26407   115.35735   -45.67268
   37    35 S   O2Z  _O32    31     1.26348   115.01060   135.22856
   38    33 S   CM   _C26    38     1.50904   106.94917  -154.72421
   39    38 S   HC   _H32    39     1.08903   117.17950   -61.35547
   40    33 S   CT   _C28    96     1.53223   110.14767    83.29717
   41    40 S   HC   _H33    97     1.09759   111.63873    65.22827
   42    40 S   HC   _H34    98     1.09716   111.19095   -54.16114
   43    38 S   CM   _C25    40     1.34231   123.22095   117.68227
   44    43 S   HC   _H31    41     1.08735   119.60055     1.22173
   45    40 S   C    _C29    99     1.51708   111.16660  -174.11660
   46    45 S   O    _O36   100     1.22852   121.83616  -104.33430
   47    43 S   CM   _C24    42     1.44497   123.08025  -176.93229
   48    47 S   HC   _H30    43     1.08640   116.70812     0.65760
   49    45 S   N    _N5_   101     1.38413   113.04556    74.98772
   50    49 S   H    _H35   102     1.01588   119.34570     1.67760
   51    47 S   CM   _C23    44     1.34348   122.89689   178.13240
   52    51 S   HC   _H29    45     1.09020   118.32611     1.22253
   53    49 S   CT1  _C30   103     1.44180   122.09324  -176.62844
   54    53 S   HC   _H36   104     1.09337   112.74491   -29.55850
   55    51 S   CT   _C19    46     1.52325   126.12066  -176.08979
   56    53 S   CO4  _C31   105     1.50983   110.86080  -153.71289
   57    56 S   O    _O37   106     1.22384   124.76936    50.71365
   58    55 S   CM   _C18    47     1.52084   107.58169   105.41564
   59    58 S   HC   _H28    48     1.08628   114.22145    63.96677
   60    55 S   OH   _O39    94     1.43477   106.84187  -139.05020
   61    60 S   HO   _H41    95     0.97225   108.70733   -63.24164
   62    56 S   CT   _C32   107     1.50869   111.24543  -131.26184
   63    62 S   HC   _H37   108     1.09282   110.91142   140.34845
   64    62 S   HC   _H38   109     1.09425   108.59685   -98.71583
   65    58 S   CM   _C17    49     1.34429   126.01329  -112.75344
   66    62 S   CT   _C33   110     1.52923   104.95239    19.90513
   67    66 S   HC   _H39   111     1.09280   111.41905  -137.57208
   68    66 S   HC   _H40   112     1.09445   110.56175    99.80549
   69    65 S   CO4  _C22    50     1.49910   119.75278    -2.66109
   70    69 S   O    _O34    51     1.22603   121.83261   172.04127
   71    65 S   N    _N4_    57     1.38247   125.76011   175.75185
   72    71 S   H    _H27    58     1.01871   114.22152  -175.59371
   73    53 S   CO4  _C34   113     1.51315   109.89770    93.15283
   74    73 S   O    _O38   114     1.22444   124.82947   -56.44416
   75    69 S   C3T  _C21    52     1.47575   118.06071    -9.38666
   76    75 S   HC   _H5_    53     1.08363   116.43859   161.58916
   77    71 S   C    _C16    59     1.38662   128.54808     4.73056
   78    77 S   O    _O33    60     1.22641   127.83464     6.89427
   79    55 S   C3T  _C20    54     1.50732   114.29919   -22.25733
   80    79 S   HC   _H4_    55     1.08147   114.84642   -44.09495
   81    77 S   CM   _C14    61     1.49681   112.64489  -175.91774
   82    75 S   O3T  _O35    56     1.43860   113.14905   -57.98138
   83    81 S   CM   _C13    62     1.34587   116.91077    59.22368
   84    83 S   HC   _H23    63     1.08992   119.43651    -1.79461
   85    81 S   CT   _C15    90     1.49651   115.36807  -121.74384
   86    85 S   HC   _H24    91     1.09462   110.37849   -74.80091
   87    85 S   HC   _H25    92     1.09552   110.31355    44.79937
   88    85 S   HC   _H26    93     1.09371   112.60945   163.93006
   89    83 S   CM   _C11    64     1.45744   127.19859   178.74477
   90    89 S   CM   _C10    65     1.34764   121.12997   -57.03699
   91    90 S   HC   _H19    66     1.09076   118.14818     1.54940
   92    89 S   CT   _C12    86     1.50325   113.46424   125.13662
   93    92 S   HC   _H20    87     1.09521   110.43226    71.68469
   94    92 S   HC   _H21    88     1.09243   113.21272  -167.09591
   95    92 S   HC   _H22    89     1.09635   110.50809   -48.03530
   96    90 S   CT   _C8_    67     1.51151   127.60894  -177.44702
   97    96 S   HC   _H3_    68     1.09461   110.98780    10.85299
   98    96 S   CT   _C9_    69     1.53070   109.12792  -107.73823
   99    98 S   HC   _H16    70     1.09602   111.57713   -61.46051
  100    98 S   HC   _H17    71     1.09586   110.98580    58.93775
  101    98 S   HC   _H18    72     1.09538   110.72243   178.38808
  102    96 S   CT   _C7_    73     1.54243   111.68534   130.44335
  103   102 S   HC   _H14    74     1.09787   108.74417   175.92879
  104   102 S   HC   _H15    75     1.09807   110.05273    59.62042
  105   102 S   CT   _C6_    76     1.53340   113.24417   -63.04329
  106   105 S   HC   _H12    77     1.09594   110.09506    63.23410
  107   105 S   HC   _H13    78     1.09668   109.64571   -54.53102
  108   105 S   CT   _C5_    79     1.52931   111.01258  -175.67727
  109   108 S   HC   _H10    80     1.09623   109.78636    60.49726
  110   108 S   HC   _H11    81     1.09624   109.90799   -57.20030
  111   108 S   CT   _C4_    82     1.51976   111.60395  -178.35587
  112   111 S   HC   _H7_    83     1.09436   110.84047    61.88213
  113   111 S   HC   _H8_    84     1.09446   110.26673  -178.60072
  114   111 S   HC   _H9_    85     1.09456   111.09866   -58.75109
  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
  12   7   2   1   1  10   4   8   4   3   6   3   7   3   7   3
   9   4  11   4  11   6  12   9   5  13   5   6   1   7   5   4
  11   4   3   2   9   5   7   3   1   1   4   3   9   3   2   1
   9   1  13   4   4   2   1   1  10  15   5   4   2   1   1  12
   8   7   3   2   1   9   5   4   9   5   4   6   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    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    43    40    41    42    45  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    43    44    47    40    41    42    45    46    49  
   38    39    43    40    41    42    45  
   36    37  
   37  
    0  
   39    43    44    47    48    51    40    41    42    45  
   43    44    47    40  
   41    42    45    46    49    50    53    43  
   42    45    46    49  
   45    46    49  
   44    47    48    51    52    55  
   47    48    51  
   46    49    50    53    54    56    73  
   49    50    53  
   48    51    52    55    58    79    60  
   51    52    55  
   50    53    54    56    57    62    66    73    74  
   53    54    56    73  
   52    55    58    59    65    75    79    80    82    60    61  
   55    58    79    60  
   54    56    57    62    63    64    66    67    68    73    74  
   56    57    62    66    73    74  
   58    59    65    69    75    76    79    80    82    71    60    61  
   57    62    63    64    66    67    68    73    74  
   62    63    64    66    73  
   59    65    69    70    75    79    80    82    71    72    77    60    61  
   65    69    79    71    60  
   61    65    75    79    80    82  
   79  
   63    64    66    67    68    73    74  
   64    66    67    68    73  
   66    67    68    73  
   69    70    75    76    79    82    71    72    77    78    81  
   67    68    73    74  
   68    73    74  
   73    74  
   70    75    76    79    80    82    71    72    77  
   75    76    79    82    71  
   72    77    78    81    83    85    75  
   77    78    81  
   74  
    0  
   76    79    80    82  
   79    80    82  
   78    81    83    84    89    85    86    87    88  
   81    83    85  
   80    82  
   82  
   83    84    89    90    92    85    86    87    88  
    0  
   84    89    90    91    96    92    93    94    95    85    86    87    88  
   89    90    92    85  
   86    87    88    89  
   87    88  
   88  
    0  
   90    91    96    97    98   102    92    93    94    95  
   91    96    97    98    99   100   101   102   103   104   105    92    93    94    95  
   96    97    98   102    92  
   93    94    95    96  
   94    95  
   95  
    0  
   97    98    99   100   101   102   103   104   105   106   107   108  
   98    99   100   101   102   103   104   105  
   99   100   101   102   103   104   105  
  100   101   102  
  101   102  
  102  
  103   104   105   106   107   108   109   110   111  
  104   105   106   107   108  
  105   106   107   108  
  106   107   108   109   110   111   112   113   114  
  107   108   109   110   111  
  108   109   110   111  
  109   110   111   112   113   114  
  110   111   112   113   114  
  111   112   113   114  
  112   113   114  
  113   114  
  114  
    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   2.5000   0.0300   0.060000   1.4250   1.2500   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   44   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   45   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   47   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   48   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   49   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   50   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   51   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   52   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   55   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   56   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   58   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   59   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   60   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   61   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   62   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5500   0.0760   0.051300   2.0020   1.7750   0.023028004  -0.852763146
   66   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   70   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   71   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
   72   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   73   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   74   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   75   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   76   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   77   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   78   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   79   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5500   0.0760  -0.056700   2.0020   1.7750   0.023028004  -0.852763146
   82   2.9000   0.1400  -0.352400   1.5900   1.4000   0.020110767  -0.896042159
   83   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   84   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   85   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   90   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   91   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   92   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   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
  102   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  112   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  113   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  114   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  1.510
   33    40   268.000  1.529
   38    39   340.000  1.080
   38    43   549.000  1.340
   43    44   340.000  1.080
   43    47   380.000  1.444
   47    48   340.000  1.080
   47    51   549.000  1.340
   51    52   340.000  1.080
   51    55   317.000  1.510
   55    58   317.000  1.510
   55    79   275.000  1.510
   55    60   320.000  1.410
   58    59   340.000  1.080
   58    65   549.000  1.340
   65    69   320.000  1.462
   65    71   400.000  1.384
   69    70   570.000  1.229
   69    75   290.000  1.496
   75    76   340.000  1.088
   75    79   260.000  1.509
   75    82   335.000  1.432
   79    80   340.000  1.088
   79    82   335.000  1.432
   71    72   434.000  1.010
   71    77   490.000  1.335
   77    78   570.000  1.229
   77    81   410.000  1.444
   81    83   549.000  1.340
   81    85   317.000  1.510
   83    84   340.000  1.080
   83    89   380.000  1.444
   89    90   549.000  1.340
   89    92   317.000  1.510
   90    91   340.000  1.080
   90    96   317.000  1.510
   96    97   340.000  1.090
   96    98   268.000  1.529
   96   102   268.000  1.529
   98    99   340.000  1.090
   98   100   340.000  1.090
   98   101   340.000  1.090
  102   103   340.000  1.090
  102   104   340.000  1.090
  102   105   268.000  1.529
  105   106   340.000  1.090
  105   107   340.000  1.090
  105   108   268.000  1.529
  108   109   340.000  1.090
  108   110   340.000  1.090
  108   111   268.000  1.529
  111   112   340.000  1.090
  111   113   340.000  1.090
  111   114   340.000  1.090
   92    93   340.000  1.090
   92    94   340.000  1.090
   92    95   340.000  1.090
   85    86   340.000  1.090
   85    87   340.000  1.090
   85    88   340.000  1.090
   60    61   553.000  0.945
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    45   317.000  1.522
   45    46   570.000  1.229
   45    49   490.000  1.335
   49    50   434.000  1.010
   49    53   337.000  1.449
   53    54   340.000  1.090
   53    56   255.000  1.522
   53    73   255.000  1.522
   56    57   570.000  1.229
   56    62   317.000  1.522
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    66   268.000  1.529
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    73   317.000  1.522
   73    74   570.000  1.229
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  112.20000
   29    33    40    75.00000  111.63000
   33    38    39    35.00000  117.00000
   33    38    43    70.00000  124.00000
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    45    63.00000  111.10000
   38    33    34    35.00000  109.50000
   38    43    44    35.00000  120.00000
   38    43    47    70.00000  123.01800
   43    38    39    35.00000  120.00000
   43    47    48    35.00000  120.00000
   43    47    51    70.00000  123.01800
   47    43    44    35.00000  120.00000
   47    51    52    35.00000  120.00000
   47    51    55    70.00000  124.00000
   51    47    48    35.00000  120.00000
   51    55    58    70.00000  110.12100
   51    55    79    70.00000  112.02700
   51    55    60    90.00000  110.39200
   55    51    52    35.00000  117.00000
   55    58    59    35.00000  117.00000
   55    58    65    70.00000  124.00000
   55    79    75    60.00000  120.94000
   55    79    80    40.00000  115.04500
   55    79    82    80.00000  116.47100
   55    60    61    55.00000  108.50000
   58    65    69    65.00000  118.96000
   58    65    71    75.00000  120.83300
   65    58    59    35.00000  120.00000
   65    69    70    80.00000  123.72100
   65    69    75    65.00000  118.62400
   65    71    72    45.00000  117.55000
   65    71    77    70.00000  120.89900
   69    75    76    40.00000  116.18000
   69    75    79    65.00000  117.18000
   69    75    82    80.00000  114.91000
   75    69    70    75.00000  121.36600
   75    79    80    37.50000  117.20000
   75    79    82    15.00000   60.43100
   75    82    79    15.00000   59.14900
   79    55    58    70.00000  112.02700
   79    75    76    37.50000  117.20000
   82    75    76    50.00000  114.27700
   82    75    79    15.00000   60.43100
   82    79    80    50.00000  114.27700
   71    65    69    70.00000  117.92000
   71    77    78    80.00000  122.90000
   71    77    81    80.00000  111.56200
   77    71    72    35.00000  119.80000
   77    81    83    70.00000  118.70000
   77    81    85    70.00000  119.70000
   81    77    78    80.00000  125.30000
   81    83    84    35.00000  120.00000
   81    83    89    70.00000  123.01800
   81    85    86    35.00000  109.50000
   81    85    87    35.00000  109.50000
   81    85    88    35.00000  109.50000
   83    89    90    70.00000  123.01800
   83    89    92    70.00000  124.00000
   89    83    84    35.00000  120.00000
   89    90    91    35.00000  120.00000
   89    90    96    70.00000  124.00000
   89    92    93    35.00000  109.50000
   89    92    94    35.00000  109.50000
   89    92    95    35.00000  109.50000
   90    96    97    35.00000  109.50000
   90    96    98    70.00000  112.02700
   90    96   102    70.00000  112.02700
   96    90    91    35.00000  117.00000
   96    98    99    37.50000  110.70000
   96    98   100    37.50000  110.70000
   96    98   101    37.50000  110.70000
   96   102   103    37.50000  110.70000
   96   102   104    37.50000  110.70000
   96   102   105    58.35000  112.70000
   98    96    97    37.50000  110.70000
  100    98    99    33.00000  107.80000
  101    98    99    33.00000  107.80000
  101    98   100    33.00000  107.80000
  102    96    97    37.50000  110.70000
  102    96    98    58.35000  112.70000
  102   105   106    37.50000  110.70000
  102   105   107    37.50000  110.70000
  102   105   108    58.35000  112.70000
  104   102   103    33.00000  107.80000
  105   102   103    37.50000  110.70000
  105   102   104    37.50000  110.70000
  105   108   109    37.50000  110.70000
  105   108   110    37.50000  110.70000
  105   108   111    58.35000  112.70000
  107   105   106    33.00000  107.80000
  108   105   106    37.50000  110.70000
  108   105   107    37.50000  110.70000
  108   111   112    37.50000  110.70000
  108   111   113    37.50000  110.70000
  108   111   114    37.50000  110.70000
  110   108   109    33.00000  107.80000
  111   108   109    37.50000  110.70000
  111   108   110    37.50000  110.70000
  113   111   112    33.00000  107.80000
  114   111   112    33.00000  107.80000
  114   111   113    33.00000  107.80000
   92    89    90    70.00000  124.00000
   94    92    93    33.00000  107.80000
   95    92    93    33.00000  107.80000
   95    92    94    33.00000  107.80000
   85    81    83    70.00000  124.00000
   87    85    86    33.00000  107.80000
   88    85    86    33.00000  107.80000
   88    85    87    33.00000  107.80000
   60    55    58    90.00000  110.39200
   60    55    79    50.00000  109.50000
   40    33    34    37.50000  110.70000
   40    33    38    70.00000  112.02700
   40    45    46    80.00000  120.40000
   40    45    49    70.00000  116.60000
   42    40    41    33.00000  107.80000
   45    40    41    35.00000  109.50000
   45    40    42    35.00000  109.50000
   45    49    50    35.00000  119.80000
   45    49    53    50.00000  121.90000
   49    45    46    80.00000  122.90000
   49    53    54    35.00000  109.50000
   49    53    56    80.00000  110.29000
   49    53    73    80.00000  110.29000
   53    49    50    38.00000  118.40000
   53    56    57    75.00000  123.42600
   53    56    62    65.00000  117.09000
   53    73    66    65.00000  117.09000
   53    73    74    75.00000  123.42600
   56    53    54    45.00000  110.09800
   56    62    63    35.00000  109.50000
   56    62    64    35.00000  109.50000
   56    62    66    63.00000  111.10000
   62    56    57    80.00000  120.40000
   62    66    67    37.50000  110.70000
   62    66    68    37.50000  110.70000
   62    66    73    63.00000  111.10000
   64    62    63    33.00000  107.80000
   66    62    63    37.50000  110.70000
   66    62    64    37.50000  110.70000
   66    73    74    80.00000  120.40000
   68    66    67    33.00000  107.80000
   73    53    54    45.00000  110.09800
   73    53    56    65.00000  112.16000
   73    66    67    35.00000  109.50000
   73    66    68    35.00000  109.50000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
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   57    56    62    64   0.00000  1.0 1.0
   57    56    62    66   0.30150 -1.0 2.0
   62    66   -73    53   0.60050  1.0 1.0
   62    66   -73    53   0.05600 -1.0 2.0
   62    66   -73    53   0.26150  1.0 3.0
   62    66    73    74   0.30150 -1.0 2.0
   63    62    66    67   0.15000  1.0 3.0
   63    62    66    68   0.15000  1.0 3.0
   63    62    66    73  -0.11250  1.0 3.0
   64    62    66    67   0.15000  1.0 3.0
   64    62    66    68   0.15000  1.0 3.0
   64    62    66    73  -0.11250  1.0 3.0
   67    66    73    53   0.00000  1.0 1.0
   67    66    73    74   0.00000  1.0 1.0
   68    66    73    53   0.00000  1.0 1.0
   68    66    73    74   0.00000  1.0 1.0
   73    53    56    57   0.30150 -1.0 2.0
   73    53   -56    62   0.65300  1.0 1.0
   73    53   -56    62  -0.03850 -1.0 2.0
   73    53   -56    62   0.33900  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    39    38    43  15.00000 -1.0 2.0
   47    44    43    38  15.00000 -1.0 2.0
   43    48    47    51  15.00000 -1.0 2.0
   55    52    51    47  15.00000 -1.0 2.0
   55    59    58    65   1.10000 -1.0 2.0
   69    71    65    58   1.10000 -1.0 2.0
   65    75    69    70  10.50000 -1.0 2.0
   72    77    71    65   1.00000 -1.0 2.0
   71    81    77    78  10.50000 -1.0 2.0
   77    85    81    83  15.00000 -1.0 2.0
   89    84    83    81  15.00000 -1.0 2.0
   83    92    89    90  15.00000 -1.0 2.0
   96    91    90    89  15.00000 -1.0 2.0
   40    49    45    46  10.50000 -1.0 2.0
   50    45    49    53   1.00000 -1.0 2.0
   53    62    56    57  10.50000 -1.0 2.0
   53    66    73    74  10.50000 -1.0 2.0
END
