* LIGAND DATABASE FILE (OPLS2005)
*
001     115   118    207    327     620
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02137   100.29428   -48.39914
    3     1 S   H    _H1_     3     1.02119    77.42359    58.66808
    4     1 S   H    _H2_     4     1.02116    37.67010  -155.68095
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08610   110.54789    58.78698
   26    24 S   HC   HB22    34     1.08612   109.94660   179.10082
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C26    36     1.83172    97.86597  -178.16538
   34    33 S   HC   _H13    37     1.09664   104.19989    56.76290
   35    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   36    35 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   37    35 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   38    33 S   CA   _C27    38     1.51797   111.71749   -59.96607
   39    33 S   CM   _C25    51     1.51421   109.41911   173.97953
   40    39 S   HC   _H30    52     1.09275   115.37857    66.28576
   41    38 S   CA   _C28    39     1.39458   120.00132   114.20694
   42    41 S   HA   _H31    40     1.08718   120.55248     0.00000
   43    39 S   CMA  _C24    53     1.35596   127.04028  -113.65624
   44    43 S   OM   _O44    54     1.26932   125.66455    -0.06853
   45    41 S   CA   _C29    41     1.39477   120.02181   179.83568
   46    45 S   HA   _H32    42     1.08620   119.66653   179.98022
   47    43 S   OS   _O41    55     1.42526   109.48474   179.67494
   48    45 S   CA   _C30    43     1.39566   119.97833     0.02798
   49    47 S   CT   _C11    56     1.42303   115.84184  -150.00506
   50    49 S   HC   _H9_    57     1.09697   107.06565   -40.07083
   51    48 S   CA   _C31    44     1.39494   119.95596     0.02798
   52    48 S   OH   _O43    49     1.36194   119.43334   179.95577
   53    52 S   HO   _H35    50     0.97014   110.19364     0.03426
   54    49 S   CT   _C12    58     1.53265   110.03216  -157.39358
   55    54 S   HC   _H10    59     1.09633   109.50960    62.31735
   56    38 S   CA   _C32    45     1.39487   119.97430   -65.92357
   57    56 S   HA   _H33    46     1.08688   120.16683     0.14671
   58    51 S   OH   _O42    47     1.36270   120.50314   179.98022
   59    58 S   HO   _H34    48     0.97030   110.22504  -179.95577
   60    54 S   CT   _C13    60     1.53639   109.78631  -175.60742
   61    60 S   HC   _H11    61     1.09833   109.40504   -64.17705
   62    54 S   OH   _O40   114     1.42830   109.31012   -54.40787
   63    62 S   HO   _H29   115     0.96921   106.32831  -179.96574
   64    60 S   OS   _O35    62     1.43550   110.60485    54.87778
   65    60 S   CT   _C23   109     1.52349   113.04590   175.26852
   66    65 S   HC   _H26   110     1.08994   110.03679    39.94715
   67    65 S   HC   _H27   111     1.09100   110.03787   -80.98938
   68    64 S   CO   _C14    63     1.43045   112.98418   -60.94269
   69    68 S   HC   _H12    64     1.09726   108.96852   -59.73798
   70    65 S   OH   _O39   112     1.41703   108.64424   159.52342
   71    70 S   HO   _H28   113     0.97232   107.01114   179.97202
   72    49 S   CT   _C10    65     1.52936   110.99569    78.36472
   73    72 S   HC   _H8_    66     1.09581   110.81326   -61.82352
   74    68 S   OS   _O36    89     1.42402   110.66940  -177.87708
   75    72 S   OS   _O34    67     1.42027   109.56637    55.18687
   76    74 S   CT   _C15    90     1.41982   111.42679    77.85918
   77    76 S   HC   _H17    91     1.09527   107.81182    59.99868
   78    76 S   HC   _H18    92     1.09524   108.81591   -57.76167
   79    75 S   CO   _C9_    68     1.42372   111.42350  -119.80527
   80    79 S   HC   _H7_    69     1.09739   107.79790    60.03544
   81    76 S   CT   _C16    93     1.52556   109.78019   179.53522
   82    81 S   HC   _H19    94     1.09805   109.61197   -60.64201
   83    81 S   HC   _H20    95     1.09704   109.01143  -177.02382
   84    79 S   CT   _C8_    70     1.52846   108.57136   179.57342
   85    84 S   HC   _H6_    71     1.09556   111.58476   -57.52758
   86    81 S   CA   _C17    96     1.50260   112.83640    61.67787
   87    84 S   CT   _C7_    72     1.52894   109.82109   179.03673
   88    87 S   HC   _H5_    73     1.09730   110.07423    68.38167
   89    84 S   OH   _O45    87     1.43102   109.01274    59.93352
   90    89 S   HO   _H36    88     0.96679   106.25121    59.72546
   91    86 S   CA   _C18    97     1.39455   119.99301   -89.83686
   92    91 S   HA   _H21    98     1.08680   120.55471    -0.07913
   93    87 S   CT   _C6_    74     1.53060   110.84063   -52.84391
   94    93 S   HC   _H4_    75     1.09788   109.24729   -71.67244
   95    87 S   OH   _O46    85     1.42534   110.09593  -173.98018
   96    95 S   HO   _H37    86     0.96912   106.58254   -57.99128
   97    91 S   CA   _C19    99     1.39501   119.98679   179.85463
   98    97 S   HA   _H22   100     1.08708   119.62385   179.93439
   99    93 S   CT   _C5_    76     1.53436   110.49070    50.84277
  100    99 S   HC   _H3_    77     1.09792   110.22202    66.78545
  101    93 S   OH   _O47    83     1.42601   108.08971   171.56062
  102   101 S   HO   _H38    84     0.96911   106.54029   -60.06422
  103    97 S   CA   _C20   101     1.39423   119.99988    -0.01978
  104    79 S   OS   _O33    78     1.42910   110.67654   -59.66974
  105    99 S   CT   _C4_    79     1.52616   112.11093  -173.51454
  106   105 S   HC   _H14    80     1.08935   109.84054    58.74498
  107   105 S   HC   _H15    81     1.08858   109.87775   -61.23965
  108   105 S   HC   _H16    82     1.08923   109.89752   178.73700
  109   103 S   CA   _C21   102     1.39514   120.01810    -0.04423
  110   103 S   OH   _O38   107     1.36262   119.43352  -179.98022
  111   110 S   HO   _H25   108     0.97008   110.18769    -0.06561
  112    86 S   CA   _C22   103     1.39463   119.97452    89.97599
  113   112 S   HA   _H23   104     1.08677   120.17970     0.14671
  114   109 S   OH   _O37   105     1.36238   120.53253   179.94065
  115   114 S   HO   _H24   106     0.96958   110.19528  -180.00000
  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
