* LIGAND DATABASE FILE (OPLS2005)
*
001     112   113    208    313     616
    1     0 S   NP   _N1_     1    29.04363    91.91980   -25.16468
    2     1 S   H    _HN1     2     1.02952    96.99804    17.42134
    3     1 S   H    _H1_     3     1.02829    10.07369  -163.03439
    4     1 S   H    _H2_     4     1.02782   112.04968   -95.65832
    5     1 S   CT   _CA1     5     1.50115   115.62251   134.06364
    6     5 S   HC   _HA1     6     1.09574   105.21377    68.81475
    7     5 S   CO3  _C1_     7     1.53803   112.42032   -51.42997
    8     7 S   O2Z  _O11     8     1.26373   115.00139   -43.05168
    9     7 S   O2Z  _O12     9     1.26242   114.94552   136.09406
   10     5 S   CT   _CB1    10     1.53089   107.42161  -173.20607
   11    10 S   HC   HB11    11     1.09831   109.40461   -49.80525
   12    10 S   HC   HB12    12     1.09816   110.42556    66.80691
   13    10 S   CT   _CG1    13     1.52986   112.60035  -170.80164
   14    13 S   HC   HG11    14     1.09590   110.56552   -64.52220
   15    13 S   HC   HG12    15     1.09667   109.85371    54.70303
   16    13 S   C    _CD1    16     1.51806   112.29523   175.15285
   17    16 S   O    _OE1    17     1.22729   123.31471     3.86569
   18    16 S   N    _N2_    18     1.38650   111.62007  -176.24151
   19    18 S   H    _HN2    19     1.01585   118.94540     1.90105
   20    18 S   CT1  _CA2    20     1.46225   123.42271   178.54734
   21    20 S   HC   _HA2    21     1.09741   109.38222    -0.03956
   22    20 S   C    _C2_    22     1.53518   108.57851  -115.52964
   23    22 S   O    _O2_    23     1.23054   122.29741  -148.09734
   24    20 S   CT   _CB2    32     1.53557   111.53401   121.97674
   25    24 S   HC   HB21    33     1.09398   109.33041    56.37499
   26    24 S   HC   HB22    34     1.09348   109.61727   175.32320
   27    22 S   N    _N3_    24     1.38336   113.65484    39.37134
   28    27 S   H    _HN3    25     1.01603   119.56312    -3.48054
   29    24 S   S    _SG2    35     1.82948   110.96036   -64.77291
   30    27 S   CT   _CA3    26     1.45288   123.17475   177.03899
   31    30 S   HC   HA31    27     1.09553   107.51322   -64.22901
   32    30 S   HC   HA32    28     1.09560   107.97068    52.19604
   33    29 S   CT   _C14    36     1.86883   102.66224   176.43564
   34    30 S   CO3  _C3_    29     1.52951   114.10578   174.18766
   35    34 S   O2Z  _O31    30     1.26375   116.06444    -0.84881
   36    34 S   O2Z  _O32    31     1.26431   114.41072   179.21316
   37    33 S   CT   _C15    37     1.56307   108.28626    63.72055
   38    37 S   HC   _H19    38     1.09804   110.14180    49.99345
   39    37 S   HC   _H20    39     1.09656   109.96875   -67.20729
   40    33 S   CT   _C13    68     1.56660   107.86248  -176.39348
   41    40 S   HC   _H4_    69     1.09307   107.45330  -178.36314
   42    33 S   CT   _C30   109     1.53939   109.49877   -56.89674
   43    42 S   HC   _H41   110     1.09567   112.26137   -46.10956
   44    42 S   HC   _H42   111     1.09603   111.02442  -165.81860
   45    42 S   HC   _H43   112     1.09509   111.95690    75.23111
   46    37 S   CT   _C16    40     1.53701   114.01336   171.78730
   47    46 S   HC   _H21    41     1.09276   108.68429    54.42995
   48    46 S   HC   _H22    42     1.09296   109.52676   -64.19391
   49    40 S   OH   _O38    70     1.42986   110.03171   -63.14896
   50    49 S   HO   _H44    71     0.97343   107.06524    58.87716
   51    46 S   CT   _C17    43     1.52630   113.08783   175.80413
   52    51 S   HC   _H23    44     1.09708   109.44771   -66.16193
   53    51 S   HC   _H24    45     1.09806   108.49066    49.25234
   54    51 S   CT   _C18    46     1.55110   113.76293   169.81335
   55    54 S   HC   _H5_    47     1.09720   108.33959   -62.43302
   56    54 S   CT   _C19    48     1.55707   115.98083    60.44181
   57    56 S   HC   _H6_    49     1.09782   109.06277   151.19257
   58    54 S   CT   _C29   105     1.53872   107.67906  -176.95470
   59    58 S   HC   _H38   106     1.09504   111.50552   -63.94574
   60    58 S   HC   _H39   107     1.09533   110.80525   175.52819
   61    58 S   HC   _H40   108     1.09540   110.83876    56.42098
   62    56 S   CT   _C20    50     1.55562   114.72734   -88.33384
   63    62 S   HC   _H7_    51     1.08514   108.17819    55.47217
   64    56 S   OH   _O37   103     1.42891   109.82907    35.38679
   65    64 S   HO   _H37   104     0.97218   107.64245    60.32773
   66    62 S   CO4  _C21    52     1.53266   111.34362   -65.75473
   67    66 S   O    _O33    53     1.23896   118.65202   -35.95209
   68    62 S   CT   _C28    99     1.53299   110.73582   173.85765
   69    68 S   HC   _H34   100     1.09580   111.07703    57.06339
   70    68 S   HC   _H35   101     1.09470   111.26858   -63.52954
   71    68 S   HC   _H36   102     1.09340   111.66926   176.67663
   72    66 S   CT   _C22    54     1.56434   121.71335   148.30792
   73    72 S   CT   _C23    55     1.56250   115.38139   -19.23145
   74    73 S   HC   _H8_    56     1.09490   107.57104   -52.83449
   75    72 S   CT   _C26    91     1.53915   107.01960   105.54909
   76    75 S   HC   _H28    92     1.09502   111.56226   175.89573
   77    75 S   HC   _H29    93     1.09655   111.19558    56.08287
   78    75 S   HC   _H30    94     1.09404   111.87565   -63.07377
   79    72 S   CT   _C27    95     1.55150   104.94563  -139.26444
   80    79 S   HC   _H31    96     1.09315   112.71666  -169.71061
   81    79 S   HC   _H32    97     1.09621   110.69627    68.82444
   82    79 S   HC   _H33    98     1.09643   111.98324   -50.59610
   83    73 S   CT   _C24    57     1.54133   116.21274  -175.57437
   84    83 S   HC   _H25    58     1.09215   112.94749    23.79581
   85    83 S   HC   _H26    59     1.09665   112.49926   -96.43744
   86    73 S   OH   _O36    89     1.43235   110.97327    63.17214
   87    86 S   HO   _H27    90     0.97198   108.70156    68.87684
   88    83 S   CO4  _C25    60     1.51230   111.03008   142.45537
   89    88 S   O    _O34    61     1.22437   123.10052  -107.58144
   90    88 S   OS   _O35    62     1.36281   110.53254    72.04945
   91    90 S   CT   _C11    63     1.44833   117.97531  -176.70895
   92    91 S   HC   _H3_    64     1.09681   110.20877     5.66562
   93    91 S   CT   _C12    65     1.54723   109.05916   123.37103
   94    93 S   HC   _H17    66     1.09534   109.45657    63.21721
   95    93 S   HC   _H18    67     1.09583   107.99998  -179.52687
   96    91 S   CM   _C9_    72     1.52450   108.48065  -114.29427
   97    96 S   CM   _C8_    73     1.35044   119.34605   120.71623
   98    97 S   HC   _H13    74     1.08987   116.84577    -2.22581
   99    96 S   CT   _C10    85     1.50799   116.21651   -58.44978
  100    99 S   HC   _H14    86     1.09442   110.31766   -86.70618
  101    99 S   HC   _H15    87     1.09331   112.59824   151.35331
  102    99 S   HC   _H16    88     1.09508   111.10823    33.11222
  103    97 S   C5B  _C6_    75     1.42947   128.75062   177.02060
  104   103 S   C5A  _C7_    76     1.38035   123.50319   159.71249
  105   104 S   HA   _H12    77     1.08118   129.09555    -1.84790
  106   104 S   SA   _S1_    78     1.71466   109.69392   178.38178
  107   106 S   CRA  _C5_    79     1.71920    89.48168    -0.86207
  108   103 S   N5B  _N4_    80     1.38011   120.98943   -23.46802
  109   107 S   CT   _C4_    81     1.48674   120.04353  -179.61539
  110   109 S   HC   _H9_    82     1.09460   110.86086   -60.18539
  111   109 S   HC   _H10    83     1.09461   110.84444    60.73833
  112   109 S   HC   _H11    84     1.09479   110.44900  -179.72375
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  13   5   4   3
  19   2   1   1  17   7   6  15   7   6   2   1   1   9   5   4
   5   1  12   5   4  13   8  16   7   5   2   1   1  13   8   3
   1  18   5   4   2   1   1  16  17   8   9   3   2   1   5   2
   1   1   8   5   4   2   1   6   2   8  12   6   5   2   1   9
  11   4   4   2   1   1   6   5   3   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    40    42    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    46    93    40    41    49    42    43    44    45  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    46    47    48    51    91    93    94    95    40    41    49    50    42    43    44    45  
   35    36  
   36  
    0  
   38    39    46    47    48    51    52    53    54    93    40    41    49    42    43    44    45  
   39    46    47    48    51    40    42  
   46    47    48    51    40    42  
   41    49    50    96    42    43    44    45    46    90    91    92    93    94    95  
   49    50    42    91    93    94    95  
   43    44    45    46    49    93  
   44    45  
   45  
    0  
   47    48    51    52    53    54    55    56    58  
   48    51    52    53    54  
   51    52    53    54  
   50    91    93    94    95  
   93  
   52    53    54    55    56    57    62    64    58    59    60    61  
   53    54    55    56    58  
   54    55    56    58  
   55    56    57    62    63    66    68    64    65    58    59    60    61  
   56    57    62    64    58    59    60    61  
   57    62    63    66    67    72    68    69    70    71    64    65    58    59    60    61  
   62    63    66    68    64    65    58  
   59    60    61    62    64  
   60    61  
   61  
    0  
   63    66    67    72    73    75    79    68    69    70    71    64    65  
   66    67    72    68    69    70    71    64  
   65    66    68  
    0  
   67    72    73    74    83    86    75    76    77    78    79    80    81    82    68    69    70    71  
   72    73    75    79    68  
   69    70    71    72  
   70    71  
   71  
    0  
   73    74    83    84    85    88    86    87    75    76    77    78    79    80    81    82  
   74    83    84    85    88    89    90    86    87    75    76    77    78    79    80    81    82  
   83    84    85    88    86    87    75    79  
   76    77    78    79    80    81    82    83    86  
   77    78    79  
   78    79  
   79  
   80    81    82    83    86  
   81    82  
   82  
    0  
   84    85    88    89    90    91    86    87  
   85    88    89    90    86  
   88    89    90    86  
   87    88  
    0  
   89    90    91    92    93    96  
   90    91  
   91    92    93    94    95    96    97    99  
   92    93    94    95    96    97    98   103    99   100   101   102  
   93    94    95    96    97    99  
   94    95    96    97    99  
   95    96  
   96  
   97    98   103   104   108    99   100   101   102  
   98   103   104   105   106   107   108    99   100   101   102  
  103   104   108    99  
  100   101   102   103  
  101   102  
  102  
    0  
  104   105   106   107   108   109  
  105   106   107   108   109  
  106   107   108  
  107   108   109   110   111   112  
  108   109   110   111   112  
  109   110   111   112  
  110   111   112  
  111   112  
  112  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   50   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   51   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   64   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   65   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   66   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   67   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   68   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   73   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   85   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   86   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   87   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   88   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   89   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   90   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   91   3.5000   0.0660   0.289000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   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   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   97   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   98   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   99   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   3.5500   0.0700   0.284300   2.0020   1.7750   0.001000000  -0.843144165
  104   3.5500   0.0700  -0.337600   2.0020   1.7750   0.001000000  -0.843144165
  105   2.4200   0.0300   0.231700   1.3810   1.2100   0.030040813   0.268726247
  106   3.5600   0.3950   0.001000   2.0080   1.7800   0.025682759  -1.666211680
  107   3.5500   0.0700   0.185900   2.0020   1.7750   0.001000000  -0.843144165
  108   3.2800   0.1700  -0.480300   1.8650   1.6500   0.001000000  -0.511443539
  109   3.5000   0.0660  -0.065000   2.4950   1.7500   0.005000000  -0.741685710
  110   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
  111   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
  112   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   268.000  1.529
   33    40   268.000  1.529
   33    42   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    46   268.000  1.529
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    51   268.000  1.529
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    54   268.000  1.529
   54    55   340.000  1.090
   54    56   268.000  1.529
   54    58   268.000  1.529
   56    57   340.000  1.090
   56    62   268.000  1.529
   56    64   320.000  1.410
   62    63   340.000  1.090
   62    66   317.000  1.522
   62    68   268.000  1.529
   66    67   570.000  1.229
   66    72   317.000  1.522
   72    73   268.000  1.529
   72    75   268.000  1.529
   72    79   268.000  1.529
   73    74   340.000  1.090
   73    83   268.000  1.529
   73    86   320.000  1.410
   83    84   340.000  1.090
   83    85   340.000  1.090
   83    88   317.000  1.522
   88    89   570.000  1.229
   88    90   214.000  1.327
   90    91   320.000  1.410
   91    92   340.000  1.090
   91    93   268.000  1.529
   91    96   317.000  1.510
   93    94   340.000  1.090
   93    95   340.000  1.090
   93    40   268.000  1.529
   40    41   340.000  1.090
   40    49   320.000  1.410
   49    50   553.000  0.945
   96    97   549.000  1.340
   96    99   317.000  1.510
   97    98   340.000  1.080
   97   103   320.000  1.460
  103   104   520.000  1.370
  103   108   410.000  1.394
  104   105   367.000  1.080
  104   106   265.000  1.745
  106   107   250.000  1.765
  107   108   488.000  1.335
  107   109   295.000  1.488
  109   110   340.000  1.090
  109   111   340.000  1.090
  109   112   340.000  1.090
   99   100   340.000  1.090
   99   101   340.000  1.090
   99   102   340.000  1.090
   86    87   553.000  0.945
   75    76   340.000  1.090
   75    77   340.000  1.090
   75    78   340.000  1.090
   79    80   340.000  1.090
   79    81   340.000  1.090
   79    82   340.000  1.090
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    71   340.000  1.090
   64    65   553.000  0.945
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   340.000  1.090
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  111.63000
   29    33    40    75.00000  111.63000
   29    33    42    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    46    58.35000  112.70000
   33    40    93    58.35000  112.70000
   33    40    41    37.50000  110.70000
   33    40    49    50.00000  109.50000
   33    42    43    37.50000  110.70000
   33    42    44    37.50000  110.70000
   33    42    45    37.50000  110.70000
   37    46    47    37.50000  110.70000
   37    46    48    37.50000  110.70000
   37    46    51    58.35000  112.70000
   39    37    38    33.00000  107.80000
   46    37    38    37.50000  110.70000
   46    37    39    37.50000  110.70000
   46    51    52    37.50000  110.70000
   46    51    53    37.50000  110.70000
   46    51    54    58.35000  112.70000
   48    46    47    33.00000  107.80000
   51    46    47    37.50000  110.70000
   51    46    48    37.50000  110.70000
   51    54    55    37.50000  110.70000
   51    54    56    58.35000  112.70000
   51    54    58    58.35000  112.70000
   53    51    52    33.00000  107.80000
   54    51    52    37.50000  110.70000
   54    51    53    37.50000  110.70000
   54    56    57    37.50000  110.70000
   54    56    62    58.35000  112.70000
   54    56    64    50.00000  109.50000
   54    58    59    37.50000  110.70000
   54    58    60    37.50000  110.70000
   54    58    61    37.50000  110.70000
   56    54    55    37.50000  110.70000
   56    62    63    37.50000  110.70000
   56    62    66    63.00000  111.10000
   56    62    68    58.35000  112.70000
   56    64    65    55.00000  108.50000
   62    56    57    37.50000  110.70000
   62    66    67    80.00000  120.40000
   62    66    72    70.00000  116.00000
   62    68    69    37.50000  110.70000
   62    68    70    37.50000  110.70000
   62    68    71    37.50000  110.70000
   66    62    63    35.00000  109.50000
   66    72    73    63.00000  111.10000
   66    72    75    63.00000  111.10000
   66    72    79    63.00000  111.10000
   72    66    67    80.00000  120.40000
   72    73    74    37.50000  110.70000
   72    73    83    58.35000  112.70000
   72    73    86    50.00000  109.50000
   72    75    76    37.50000  110.70000
   72    75    77    37.50000  110.70000
   72    75    78    37.50000  110.70000
   72    79    80    37.50000  110.70000
   72    79    81    37.50000  110.70000
   72    79    82    37.50000  110.70000
   73    83    84    37.50000  110.70000
   73    83    85    37.50000  110.70000
   73    83    88    63.00000  111.10000
   73    86    87    55.00000  108.50000
   83    73    74    37.50000  110.70000
   83    88    89    80.00000  120.40000
   83    88    90    81.00000  111.40000
   85    83    84    33.00000  107.80000
   88    83    84    35.00000  109.50000
   88    83    85    35.00000  109.50000
   88    90    91    83.00000  116.90000
   90    88    89    83.00000  123.40000
   90    91    92    35.00000  109.50000
   90    91    93    50.00000  109.50000
   90    91    96    85.00000  110.90400
   91    93    94    37.50000  110.70000
   91    93    95    37.50000  110.70000
   91    93    40    58.35000  112.70000
   91    96    97    70.00000  124.00000
   91    96    99    65.00000  117.92700
   93    91    92    37.50000  110.70000
   93    40    41    37.50000  110.70000
   93    40    49    50.00000  109.50000
   95    93    94    33.00000  107.80000
   40    33    37    58.35000  112.70000
   40    93    94    37.50000  110.70000
   40    93    95    37.50000  110.70000
   40    49    50    55.00000  108.50000
   49    40    41    35.00000  109.50000
   96    91    92    35.00000  109.50000
   96    91    93    70.00000  112.02700
   96    97    98    35.00000  120.00000
   96    97   103    60.00000  123.20500
   96    99   100    35.00000  109.50000
   96    99   101    35.00000  109.50000
   96    99   102    35.00000  109.50000
   97   103   104    60.00000  120.93500
   97   103   108    70.00000  118.40000
  103    97    98    40.00000  117.26300
  103   104   105    35.00000  130.70000
  103   104   106    80.00000  111.29200
  103   108   107    70.00000  110.00000
  104   106   107   120.00000   89.04400
  106   104   105    40.00000  122.38200
  106   107   108    80.00000  114.57700
  106   107   109    65.00000  125.49400
  107   109   110    45.00000  109.19200
  107   109   111    45.00000  109.19200
  107   109   112    45.00000  109.19200
  108   103   104    70.00000  111.00000
  109   107   108    65.00000  125.57700
  111   109   110    33.00000  107.80000
  112   109   110    33.00000  107.80000
  112   109   111    33.00000  107.80000
   99    96    97    70.00000  124.00000
  101    99   100    33.00000  107.80000
  102    99   100    33.00000  107.80000
  102    99   101    33.00000  107.80000
   86    73    74    35.00000  109.50000
   86    73    83    50.00000  109.50000
   75    72    73    58.35000  112.70000
   77    75    76    33.00000  107.80000
   78    75    76    33.00000  107.80000
   78    75    77    33.00000  107.80000
   79    72    73    58.35000  112.70000
   79    72    75    58.35000  112.70000
   81    79    80    33.00000  107.80000
   82    79    80    33.00000  107.80000
   82    79    81    33.00000  107.80000
   68    62    63    37.50000  110.70000
   68    62    66    63.00000  111.10000
   70    68    69    33.00000  107.80000
   71    68    69    33.00000  107.80000
   71    68    70    33.00000  107.80000
   64    56    57    35.00000  109.50000
   64    56    62    50.00000  109.50000
   58    54    55    37.50000  110.70000
   58    54    56    58.35000  112.70000
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    33.00000  107.80000
   42    33    37    58.35000  112.70000
   42    33    40    58.35000  112.70000
   44    42    43    33.00000  107.80000
   45    42    43    33.00000  107.80000
   45    42    44    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
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   64    56    62    68  -0.17500 -1.0 2.0
   64    56    62    68   0.20800  1.0 3.0
   58    54    56    57   0.15000  1.0 3.0
   58    54    56    62   0.56750  1.0 1.0
   58    54    56    62  -0.07550 -1.0 2.0
   58    54    56    62   0.20000  1.0 3.0
   58    54    56    64   0.86500  1.0 1.0
   58    54    56    64  -0.17500 -1.0 2.0
   58    54    56    64   0.20800  1.0 3.0
   42    33    37    38   0.15000  1.0 3.0
   42    33    37    39   0.15000  1.0 3.0
   42    33    37    46   0.56750  1.0 1.0
   42    33    37    46  -0.07550 -1.0 2.0
   42    33    37    46   0.20000  1.0 3.0
   42    33    40    93   0.56750  1.0 1.0
   42    33    40    93  -0.07550 -1.0 2.0
   42    33    40    93   0.20000  1.0 3.0
   42    33    40    41   0.15000  1.0 3.0
   42    33    40    49   0.86500  1.0 1.0
   42    33    40    49  -0.17500 -1.0 2.0
   42    33    40    49   0.20800  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
   35    30    34    36  10.50000 -1.0 2.0
   62    72    66    67  10.50000 -1.0 2.0
   83    90    88    89  10.50000 -1.0 2.0
   91    99    96    97  15.00000 -1.0 2.0
  103    98    97    96  15.00000 -1.0 2.0
  104   108   103    97   4.00000 -1.0 2.0
  106   105   104   103   1.10000 -1.0 2.0
  109   108   107   106   4.00000 -1.0 2.0
END
