* LIGAND DATABASE FILE (OPLS2005)
*
001     115   118    207    327     620
    1     0 S   NP   _N1_     1    28.46446    91.88616   -19.78349
    2     1 S   H    _HN1     2     1.02955   103.31727     7.71381
    3     1 S   H    _H1_     3     1.02835    28.97389   109.01244
    4     1 S   H    _H2_     4     1.02784    82.41286   -99.40997
    5     1 S   CT   _CA1     5     1.50110   135.48082   146.51442
    6     5 S   HC   _HA1     6     1.09578   105.23369    40.92183
    7     5 S   CO3  _C1_     7     1.53804   112.30418   -79.30466
    8     7 S   O2Z  _O11     8     1.26362   115.02222   -45.84431
    9     7 S   O2Z  _O12     9     1.26224   114.95119   133.21321
   10     5 S   CT   _CB1    10     1.53095   107.41787   158.84591
   11    10 S   HC   HB11    11     1.09824   109.42936   -49.96269
   12    10 S   HC   HB12    12     1.09809   110.48127    66.68789
   13    10 S   CT   _CG1    13     1.52942   112.48480  -170.94403
   14    13 S   HC   HG11    14     1.09572   110.46523   -63.35496
   15    13 S   HC   HG12    15     1.09613   109.74063    55.96125
   16    13 S   C    _CD1    16     1.51746   112.42794   176.13502
   17    16 S   O    _OE1    17     1.22729   123.25315    -0.45970
   18    16 S   N    _N2_    18     1.38617   111.61951   179.75853
   19    18 S   H    _HN2    19     1.01559   119.02063     1.84525
   20    18 S   CT1  _CA2    20     1.46155   123.43476   179.26618
   21    20 S   HC   _HA2    21     1.09733   109.07357     2.27323
   22    20 S   C    _C2_    22     1.53620   109.96670  -113.41128
   23    22 S   O    _O2_    23     1.23125   121.77331  -158.75277
   24    20 S   CT   _CB2    32     1.53481   111.37423   123.80130
   25    24 S   HC   HB21    33     1.09448   109.59962    57.64454
   26    24 S   HC   HB22    34     1.09504   110.54388   176.53062
   27    22 S   N    _N3_    24     1.38343   114.30818    28.49487
   28    27 S   H    _HN3    25     1.01509   119.21747    -5.29184
   29    24 S   S    _SG2    35     1.82995   111.42861   -63.63308
   30    27 S   CT   _CA3    26     1.45358   122.78940   176.01690
   31    30 S   HC   HA31    27     1.09567   107.17997   -67.65499
   32    30 S   HC   HA32    28     1.09554   108.45246    48.39770
   33    29 S   CT   _C26    36     1.84335    99.81147   174.56491
   34    33 S   HC   _H13    37     1.09621   105.34071    51.42945
   35    30 S   CO3  _C3_    29     1.52828   113.53795   169.84822
   36    35 S   O2Z  _O31    30     1.26459   115.48090   -43.01629
   37    35 S   O2Z  _O32    31     1.26313   114.99350   137.44502
   38    33 S   CA   _C27    38     1.52152   110.54057   168.59759
   39    33 S   CM   _C25    51     1.51160   110.02297   -67.52852
   40    39 S   HC   _H30    52     1.09053   115.67491   -41.64925
   41    38 S   CA   _C28    39     1.40520   119.50041  -114.07228
   42    41 S   HA   _H31    40     1.08776   120.28997     0.39958
   43    39 S   CMA  _C24    53     1.35401   126.55587   138.45005
   44    43 S   OM   _O44    54     1.26615   126.56755    -1.07101
   45    41 S   CA   _C29    41     1.39690   120.90347  -179.27422
   46    45 S   HA   _H32    42     1.08616   119.31179   179.89913
   47    43 S   OS   _O41    55     1.41360   110.60795  -178.34708
   48    45 S   CA   _C30    43     1.39263   119.72455     0.00000
   49    47 S   CT   _C11    56     1.43974   113.39111  -110.89422
   50    49 S   HC   _H9_    57     1.09741   110.89662   -26.73654
   51    48 S   CA   _C31    44     1.39162   120.14278    -0.01978
   52    48 S   OH   _O43    49     1.36719   120.47142   179.98022
   53    52 S   HO   _H35    50     0.97199   108.66834     0.02798
   54    49 S   CT   _C12    58     1.53741   107.89507  -143.94237
   55    54 S   HC   _H10    59     1.09725   108.58261   172.93148
   56    38 S   CA   _C32    45     1.40671   121.92246    66.70334
   57    56 S   HA   _H33    46     1.08730   119.93959    -0.61517
   58    51 S   OH   _O42    47     1.36747   119.26229  -179.87028
   59    58 S   HO   _H34    48     0.97199   108.65024   179.97202
   60    54 S   CT   _C13    60     1.53179   110.84493   -66.83291
   61    60 S   HC   _H11    61     1.09716   111.19614    63.06101
   62    54 S   OH   _O40   114     1.42570   110.44960    55.16556
   63    62 S   HO   _H29   115     0.97310   107.97804    37.46809
   64    60 S   OS   _O35    62     1.43261   109.73908   -57.62956
   65    60 S   CT   _C23   109     1.53056   111.53149  -176.54611
   66    65 S   HC   _H26   110     1.09503   110.98391    68.63415
   67    65 S   HC   _H27   111     1.09394   111.59292   -53.74088
   68    64 S   CO   _C14    63     1.43092   114.26727    60.99510
   69    68 S   HC   _H12    64     1.09688   106.21287  -175.34558
   70    65 S   OH   _O39   112     1.42561   109.16640  -172.72117
   71    70 S   HO   _H28   113     0.97223   106.96500  -179.53186
   72    49 S   CT   _C10    65     1.54026   109.64736    96.21624
   73    72 S   HC   _H8_    66     1.09720   110.17750   -50.45399
   74    68 S   OS   _O36    89     1.42965   113.93901    65.82940
   75    72 S   OS   _O34    67     1.43421   109.39925  -171.54439
   76    74 S   CT   _C15    90     1.42583   113.62769    60.59640
   77    76 S   HC   _H17    91     1.09619   108.64862    53.40449
   78    76 S   HC   _H18    92     1.09558   110.21054   -65.80064
   79    75 S   CO   _C9_    68     1.43375   113.02897    89.47376
   80    79 S   HC   _H7_    69     1.09593   108.97985   -46.37346
   81    76 S   CT   _C16    93     1.53222   109.35910   171.84038
   82    81 S   HC   _H19    94     1.09719   110.13416   -44.29354
   83    81 S   HC   _H20    95     1.09694   107.27019  -160.78833
   84    79 S   CT   _C8_    70     1.53289   109.57184  -164.66285
   85    84 S   HC   _H6_    71     1.09729   109.70144   172.78768
   86    81 S   CA   _C17    96     1.51420   115.57579    78.02828
   87    84 S   CT   _C7_    72     1.52948   110.92403   -66.95992
   88    87 S   HC   _H5_    73     1.09631   110.71478    71.18783
   89    84 S   OH   _O45    87     1.42591   110.47750    54.66167
   90    89 S   HO   _H36    88     0.97242   107.69163    56.29717
   91    86 S   CA   _C18    97     1.40391   119.64256   134.63280
   92    91 S   HA   _H21    98     1.08782   120.29809    -2.39490
   93    87 S   CT   _C6_    74     1.53343   110.36163   -51.90139
   94    93 S   HC   _H4_    75     1.09712   108.90324   -71.36773
   95    87 S   OH   _O46    85     1.43060   109.73224  -172.46962
   96    95 S   HO   _H37    86     0.97218   108.15564    60.23278
   97    91 S   CA   _C19    99     1.39757   120.94034   176.75617
   98    97 S   HA   _H22   100     1.08643   119.47120  -179.57387
   99    93 S   CT   _C5_    76     1.53389   111.25277    49.88104
  100    99 S   HC   _H3_    77     1.09737   110.17216    68.02381
  101    93 S   OH   _O47    83     1.42642   109.73486   172.03459
  102   101 S   HO   _H38    84     0.97254   108.03473   -57.82049
  103    97 S   CA   _C20   101     1.39229   119.73839     0.08156
  104    79 S   OS   _O33    78     1.43188   112.50037    73.06846
  105    99 S   CT   _C4_    79     1.52538   111.60844  -173.08270
  106   105 S   HC   _H14    80     1.09557   110.96231    62.17997
  107   105 S   HC   _H15    81     1.09393   111.73718   -59.44577
  108   105 S   HC   _H16    82     1.09530   110.15672  -179.92087
  109   103 S   CA   _C21   102     1.38960   120.06991    -0.04423
  110   103 S   OH   _O38   107     1.36592   120.44130  -179.31130
  111   110 S   HO   _H25   108     0.97565   108.34100    16.59693
  112    86 S   CA   _C22   103     1.40141   121.91365   -49.14620
  113   112 S   HA   _H23   104     1.08268   120.22820     1.81919
  114   109 S   OH   _O37   105     1.36744   119.58442  -179.11884
  115   114 S   HO   _H24   106     0.97336   108.80847   178.46379
  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   8   5   4   3
  13   6   2   1   1  12   7   3   8   4   6   2   7   3  10   7
  16   8   6   3   1  14   7   3   1   1   1  13   7   4   1  11
   5   3   2  10   5   1   1   8   3   8   8   8   5   4  13   6
   9   4   3  12   7   9  13   7   4   1   8   4  12   7   3   1
   7   3   8   6   3   1   7   4   3   2   1   1   6   3   1   3
   1   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    56    39    40    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    45    51    56    57    39    40    43    44    47  
   38    41    56    39    40    43  
   36    37  
   37  
    0  
   41    42    45    46    48    51    56    57    58    39    40    43  
   40    43    44    47    49    41    56  
   43    44    47  
   42    45    46    48    51    56    57    52  
   45    46    48    56  
   44    47    49    50    54    72  
   47    49  
   46    48    51    56    58    52    53  
   48    51    52  
   49    50    54    55    60    68    72    73    75    62  
   51    56    57    58    59    52    53  
   50    54    55    60    61    64    68    69    72    73    75    79    74    65    62    63  
   54    55    60    68    72    73    75    62  
   56    57    58    59    52    53  
   53    56    58  
    0  
   55    60    61    64    68    72    73    75    65    66    67    70    62    63  
   60    61    64    72    65    62    63  
   57    58    59  
   58  
   59  
    0  
   61    64    68    69    72    74    65    66    67    70    71    62    63  
   64    68    65    66    67    70    62  
   63    64    65    72  
    0  
   68    69    72    73    75    74    76    65    66    67    70  
   66    67    70    71    68  
   67    70    71  
   70    71  
   69    72    73    75    79    74    76    77    78    81  
   72    73    75    74    76  
   71  
    0  
   73    75    79    80    84   104    74    76  
   75    79    74  
   76    77    78    81    82    83    86    75  
   79    80    84    85    87    99   104    89  
   77    78    81    82    83    86    91   112  
   78    81    82    83    86  
   81    82    83    86  
   80    84    85    87    88    93    99   100   104   105    95    89    90  
   84    85    87    99   104    89  
   82    83    86    91    92    97   109   112   113  
   83    86    91   112  
   86    91   112  
   85    87    88    93    94    99   104   101    95    96    89    90  
   87    88    93   104    95    89    90  
   91    92    97    98   103   109   112   113   114  
   88    93    94    99   100   104   105   101   102    95    96    89    90  
   93    94    99   101    95    96    89  
   90    93    95   104  
    0  
   92    97    98   103   109   112   113   110  
   97    98   103   112  
   94    99   100   104   105   106   107   108   101   102    95    96  
   99   100   104   105   101   102    95  
   96    99   101  
    0  
   98   103   109   112   114   110   111  
  103   109   110  
  100   104   105   106   107   108   101   102  
  104   105   106   107   108   101  
  102   104   105  
    0  
  109   112   113   114   115   110   111  
  105   106   107   108  
  106   107   108  
  107   108  
  108  
    0  
  112   113   114   115   110   111  
  111   112   114  
    0  
  113   114   115  
  114  
  115  
    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   0.222500   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   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   40   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   43   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   44   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   2.8500   0.1400  -0.685000   1.7660   1.5600   0.020110767  -0.896042159
   48   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   49   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   52   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   53   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   54   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   57   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   58   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   59   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   60   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   62   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   63   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   64   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   65   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   70   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   71   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   72   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   74   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   75   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   76   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   77   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   78   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   79   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5000   0.0660  -0.005000   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   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   87   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   90   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   91   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   92   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   93   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   96   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   97   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   98   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   99   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
  100   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  101   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  102   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  103   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
  104   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
  105   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
  110   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
  111   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
  112   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  113   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  114   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
  115   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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    39   317.000  1.510
   38    41   469.000  1.400
   38    56   469.000  1.400
   41    42   367.000  1.080
   41    45   469.000  1.400
   45    46   367.000  1.080
   45    48   469.000  1.400
   48    51   469.000  1.400
   48    52   450.000  1.364
   51    56   469.000  1.400
   51    58   450.000  1.364
   56    57   367.000  1.080
   58    59   553.000  0.945
   52    53   553.000  0.945
   39    40   340.000  1.080
   39    43   465.000  1.376
   43    44   745.000  1.250
   43    47   440.000  1.360
   47    49   320.000  1.410
   49    50   340.000  1.090
   49    54   268.000  1.529
   49    72   268.000  1.529
   54    55   340.000  1.090
   54    60   268.000  1.529
   54    62   320.000  1.410
   60    61   340.000  1.090
   60    64   320.000  1.410
   60    65   268.000  1.529
   64    68   320.000  1.380
   68    69   340.000  1.090
   68    72   250.000  1.527
   68    74   320.000  1.380
   72    73   340.000  1.090
   72    75   320.000  1.410
   75    79   320.000  1.380
   79    80   340.000  1.090
   79    84   250.000  1.527
   79   104   320.000  1.380
   84    85   340.000  1.090
   84    87   268.000  1.529
   84    89   320.000  1.410
   87    88   340.000  1.090
   87    93   268.000  1.529
   87    95   320.000  1.410
   93    94   340.000  1.090
   93    99   268.000  1.529
   93   101   320.000  1.410
   99   100   340.000  1.090
   99   104   320.000  1.410
   99   105   268.000  1.529
  105   106   340.000  1.090
  105   107   340.000  1.090
  105   108   340.000  1.090
  101   102   553.000  0.945
   95    96   553.000  0.945
   89    90   553.000  0.945
   74    76   320.000  1.410
   76    77   340.000  1.090
   76    78   340.000  1.090
   76    81   268.000  1.529
   81    82   340.000  1.090
   81    83   340.000  1.090
   81    86   317.000  1.510
   86    91   469.000  1.400
   86   112   469.000  1.400
   91    92   367.000  1.080
   91    97   469.000  1.400
   97    98   367.000  1.080
   97   103   469.000  1.400
  103   109   469.000  1.400
  103   110   450.000  1.364
  109   112   469.000  1.400
  109   114   450.000  1.364
  112   113   367.000  1.080
  114   115   553.000  0.945
  110   111   553.000  0.945
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    70   320.000  1.410
   70    71   553.000  0.945
   62    63   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    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    80.00000  109.48900
   29    33    39    75.00000  112.20000
   33    38    41    70.00000  120.00000
   33    38    56    70.00000  120.00000
   33    39    40    35.00000  117.00000
   33    39    43    70.00000  124.00000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    45    63.00000  120.00000
   38    56    51    63.00000  120.00000
   38    56    57    35.00000  120.00000
   41    45    46    35.00000  120.00000
   41    45    48    63.00000  120.00000
   45    41    42    35.00000  120.00000
   45    48    51    63.00000  120.00000
   45    48    52    70.00000  120.00000
   48    45    46    35.00000  120.00000
   48    51    56    63.00000  120.00000
   48    51    58    70.00000  120.00000
   48    52    53    35.00000  113.00000
   51    56    57    35.00000  120.00000
   51    58    59    35.00000  113.00000
   56    38    41    63.00000  120.00000
   58    51    56    70.00000  120.00000
   52    48    51    70.00000  120.00000
   39    33    34    35.00000  109.50000
   39    33    38    70.00000  112.99600
   39    43    44    65.00000  137.10300
   39    43    47    80.00000  120.01400
   43    39    40    40.00000  120.50800
   43    47    49    90.00000  111.18400
   47    43    44    65.00000  121.00000
   47    49    50    35.00000  109.50000
   47    49    54    50.00000  109.50000
   47    49    72    50.00000  109.50000
   49    54    55    37.50000  110.70000
   49    54    60    58.35000  112.70000
   49    54    62    50.00000  109.50000
   49    72    68    75.00000  109.43000
   49    72    73    37.50000  110.70000
   49    72    75    50.00000  109.50000
   54    49    50    37.50000  110.70000
   54    60    61    37.50000  110.70000
   54    60    64    50.00000  109.50000
   54    60    65    58.35000  112.70000
   54    62    63    55.00000  108.50000
   60    54    55    37.50000  110.70000
   60    64    68    60.00000  109.50000
   60    65    66    37.50000  110.70000
   60    65    67    37.50000  110.70000
   60    65    70    50.00000  109.50000
   64    60    61    35.00000  109.50000
   64    68    69    35.00000  109.50000
   64    68    72    90.00000  108.56700
   64    68    74    92.60000  111.55000
   68    72    73    45.00000  108.72000
   68    72    75    90.00000  109.38000
   68    74    76    60.00000  109.50000
   72    49    50    37.50000  110.70000
   72    49    54    58.35000  112.70000
   72    68    69    45.00000  112.01100
   72    75    79    60.00000  109.50000
   75    72    73    35.00000  109.50000
   75    79    80    35.00000  109.50000
   75    79    84    90.00000  108.56700
   75    79   104    92.60000  111.55000
   79    84    85    45.00000  108.72000
   79    84    87    75.00000  109.43000
   79    84    89    90.00000  111.58700
   79   104    99    60.00000  109.50000
   84    79    80    45.00000  112.01100
   84    87    88    37.50000  110.70000
   84    87    93    58.35000  112.70000
   84    87    95    50.00000  109.50000
   84    89    90    55.00000  108.50000
   87    84    85    37.50000  110.70000
   87    93    94    37.50000  110.70000
   87    93    99    58.35000  112.70000
   87    93   101    50.00000  109.50000
   87    95    96    55.00000  108.50000
   93    87    88    37.50000  110.70000
   93    99   100    37.50000  110.70000
   93    99   104    50.00000  109.50000
   93    99   105    58.35000  112.70000
   93   101   102    55.00000  108.50000
   99    93    94    37.50000  110.70000
   99   105   106    37.50000  110.70000
   99   105   107    37.50000  110.70000
   99   105   108    37.50000  110.70000
  104    79    80    35.00000  109.50000
  104    79    84    90.00000  108.56700
  104    99   100    35.00000  109.50000
  105    99   100    37.50000  110.70000
  105    99   104    50.00000  109.50000
  107   105   106    33.00000  107.80000
  108   105   106    33.00000  107.80000
  108   105   107    33.00000  107.80000
  101    93    94    35.00000  109.50000
  101    93    99    50.00000  109.50000
   95    87    88    35.00000  109.50000
   95    87    93    50.00000  109.50000
   89    84    85    35.00000  109.50000
   89    84    87    50.00000  109.50000
   74    68    69    35.00000  109.50000
   74    68    72    90.00000  108.56700
   74    76    77    35.00000  109.50000
   74    76    78    35.00000  109.50000
   74    76    81    50.00000  109.50000
   76    81    82    37.50000  110.70000
   76    81    83    37.50000  110.70000
   76    81    86    70.00000  112.17500
   78    76    77    33.00000  107.80000
   81    76    77    37.50000  110.70000
   81    76    78    37.50000  110.70000
   81    86    91    70.00000  120.00000
   81    86   112    70.00000  120.00000
   83    81    82    33.00000  107.80000
   86    81    82    35.00000  109.50000
   86    81    83    35.00000  109.50000
   86    91    92    35.00000  120.00000
   86    91    97    63.00000  120.00000
   86   112   109    63.00000  120.00000
   86   112   113    35.00000  120.00000
   91    97    98    35.00000  120.00000
   91    97   103    63.00000  120.00000
   97    91    92    35.00000  120.00000
   97   103   109    63.00000  120.00000
   97   103   110    70.00000  120.00000
  103    97    98    35.00000  120.00000
  103   109   112    63.00000  120.00000
  103   109   114    70.00000  120.00000
  103   110   111    35.00000  113.00000
  109   112   113    35.00000  120.00000
  109   114   115    35.00000  113.00000
  112    86    91    63.00000  120.00000
  114   109   112    70.00000  120.00000
  110   103   109    70.00000  120.00000
   65    60    61    37.50000  110.70000
   65    60    64    50.00000  109.50000
   65    70    71    55.00000  108.50000
   67    65    66    33.00000  107.80000
   70    65    66    35.00000  109.50000
   70    65    67    35.00000  109.50000
   62    54    55    35.00000  109.50000
   62    54    60    50.00000  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
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   77    76    81    82   0.15000  1.0 3.0
   77    76    81    83   0.15000  1.0 3.0
   77    76    81    86   0.43200  1.0 3.0
   78    76    81    82   0.15000  1.0 3.0
   78    76    81    83   0.15000  1.0 3.0
   78    76    81    86   0.43200  1.0 3.0
   81    86    91    92   3.62500 -1.0 2.0
   81    86    91    97   3.62500 -1.0 2.0
   81    86   112   109   3.62500 -1.0 2.0
   81    86   112   113   3.62500 -1.0 2.0
   82    81    86    91   0.00000  1.0 1.0
   82    81    86   112   0.00000  1.0 1.0
   83    81    86    91   0.00000  1.0 1.0
   83    81    86   112   0.00000  1.0 1.0
   86    91    97    98   3.62500 -1.0 2.0
   86    91    97   103   3.62500 -1.0 2.0
   91    86   112   109   3.62500 -1.0 2.0
   91    86   112   113   3.62500 -1.0 2.0
   91    97  -103   109   3.62500 -1.0 2.0
   91    97   103   110   3.62500 -1.0 2.0
   92    91    97    98   3.62500 -1.0 2.0
   92    91    97   103   3.62500 -1.0 2.0
   97   103   109   112   3.62500 -1.0 2.0
   97   103   109   114   3.62500 -1.0 2.0
   97   103   110   111   0.84100 -1.0 2.0
   98    97   103   109   3.62500 -1.0 2.0
   98    97   103   110   3.62500 -1.0 2.0
  103   109  -112    86   3.62500 -1.0 2.0
  103   109   112   113   3.62500 -1.0 2.0
  103   109   114   115   0.84100 -1.0 2.0
  109   103   110   111   0.84100 -1.0 2.0
  112    86    91    92   3.62500 -1.0 2.0
  112    86   -91    97   3.62500 -1.0 2.0
  112   109   114   115   0.84100 -1.0 2.0
  114   109   112    86   3.62500 -1.0 2.0
  114   109   112   113   3.62500 -1.0 2.0
  110   103   109   112   3.62500 -1.0 2.0
  110   103   109   114   3.62500 -1.0 2.0
   65    60    64    68   0.06250  1.0 1.0
   65    60    64    68  -0.01100 -1.0 2.0
   65    60    64    68   0.28050  1.0 3.0
   66    65    70    71   0.19450  1.0 3.0
   67    65    70    71   0.19450  1.0 3.0
   62    54    60    61   0.23400  1.0 3.0
   62    54    60    64   3.69350  1.0 1.0
   62    54    60    64  -1.82950 -1.0 2.0
   62    54    60    65   0.86500  1.0 1.0
   62    54    60    65  -0.17500 -1.0 2.0
   62    54    60    65   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
   36    30    35    37  10.50000 -1.0 2.0
   41    56    38    33   4.00000 -1.0 2.0
   45    42    41    38   1.10000 -1.0 2.0
   48    46    45    41   1.10000 -1.0 2.0
   51    52    48    45   4.00000 -1.0 2.0
   56    58    51    48   4.00000 -1.0 2.0
   51    57    56    38   1.10000 -1.0 2.0
   33    40    39    43  15.00000 -1.0 2.0
   44    47    43    39  15.00000 -1.0 2.0
   91   112    86    81   4.00000 -1.0 2.0
   97    92    91    86   1.10000 -1.0 2.0
  103    98    97    91   1.10000 -1.0 2.0
  109   110   103    97   4.00000 -1.0 2.0
  112   114   109   103   4.00000 -1.0 2.0
  109   113   112    86   1.10000 -1.0 2.0
END
