* LIGAND DATABASE FILE (OPLS2005)
*
001     114   114    211    316     628
    1     0 S   NP   _N1_     1    28.39874    99.45238   -22.45270
    2     1 S   H    _HN1     2     1.02834    53.16381   159.56913
    3     1 S   H    _H1_     3     1.02775   102.54512   -97.31374
    4     1 S   H    _H2_     4     1.02959    58.41919     6.68398
    5     1 S   CT   _CA1     5     1.50134   145.08989    87.06268
    6     5 S   HC   _HA1     6     1.09575   105.20970   113.84927
    7     5 S   CO3  _C1_     7     1.53792   112.39941    -6.31702
    8     7 S   O2Z  _O11     8     1.26363   114.98668   -42.72018
    9     7 S   O2Z  _O12     9     1.26239   114.93566   136.38186
   10     5 S   CT   _CB1    10     1.53099   107.41912  -128.23647
   11    10 S   HC   HB11    11     1.09825   109.32558   -50.51190
   12    10 S   HC   HB12    12     1.09816   110.42242    66.05132
   13    10 S   CT   _CG1    13     1.52998   112.66693  -171.60216
   14    13 S   HC   HG11    14     1.09604   110.45615   -64.44759
   15    13 S   HC   HG12    15     1.09656   109.94674    54.74336
   16    13 S   C    _CD1    16     1.51838   112.37338   175.09895
   17    16 S   O    _OE1    17     1.22734   123.33350    -1.05276
   18    16 S   N    _N2_    18     1.38528   111.62137   178.93578
   19    18 S   H    _HN2    19     1.01571   118.93600     4.99175
   20    18 S   CT1  _CA2    20     1.45849   123.01926   178.41119
   21    20 S   HC   _HA2    21     1.09688   109.15151    21.48106
   22    20 S   C    _C2_    22     1.52734   106.58924   -96.29916
   23    22 S   O    _O2_    23     1.22993   122.73867   -36.60717
   24    20 S   CT   _CB2    32     1.53017   111.79383   144.77891
   25    24 S   HC   HB21    33     1.09566   109.86295    52.25126
   26    24 S   HC   HB22    34     1.09504   110.43094   171.17425
   27    22 S   N    _N3_    24     1.38385   112.72943   146.08133
   28    27 S   H    _HN3    25     1.01637   120.40437    -2.21629
   29    24 S   S    _SG2    35     1.82627   110.85107   -68.91612
   30    27 S   CT   _CA3    26     1.45372   122.54304   178.58197
   31    30 S   HC   HA31    27     1.09566   107.51167   -62.83979
   32    30 S   HC   HA32    28     1.09560   107.91517    53.51666
   33    29 S   CT   _C9_    36     1.84720   100.27642   151.52357
   34    33 S   HC   _H6_    37     1.09413   105.95485   -50.25486
   35    30 S   CO3  _C3_    29     1.52926   114.27332   175.49567
   36    35 S   O2Z  _O31    30     1.26350   116.05662    -0.20271
   37    35 S   O2Z  _O32    31     1.26426   114.46031   179.65622
   38    33 S   CT   _C10    38     1.54892   108.84131    67.15944
   39    38 S   HC   _H18    39     1.09503   108.88164   -56.77624
   40    38 S   HC   _H19    40     1.09822   109.38501    58.72247
   41    33 S   CT   _C8_    97     1.55397   111.11552  -167.53315
   42    41 S   HC   _H5_    98     1.09498   106.86748   173.34636
   43    38 S   CT   _C11    41     1.54923   115.54320  -179.11397
   44    43 S   HC   _H7_    42     1.09613   108.99200   -58.74720
   45    41 S   CT   _C5_    99     1.55458   117.08461    53.39804
   46    45 S   HC   _H3_   100     1.09789   109.07141   -61.61769
   47    41 S   OH   _O41   113     1.42893   109.55755   -72.49695
   48    47 S   HO   _H46   114     0.97672   108.11569    72.48609
   49    43 S   CT   _C12    43     1.53698   112.67492    60.79110
   50    49 S   HC   _H20    44     1.09704   111.00832  -172.42539
   51    49 S   HC   _H21    45     1.09346   111.32315   -54.39010
   52    45 S   CT   _C4_   101     1.53557   111.58959    56.08119
   53    52 S   HC   _H11   102     1.09476   111.40130    54.51075
   54    52 S   HC   _H12   103     1.09466   111.47978   175.35641
   55    52 S   HC   _H13   104     1.09435   111.22122   -65.68418
   56    45 S   CT   _C6_   105     1.55269   112.21695  -177.30557
   57    56 S   HC   _H4_   106     1.09597   109.24539    57.68986
   58    49 S   OS   _O34    46     1.42766   111.32402    65.91490
   59    56 S   CT   _C7_   107     1.52486   115.01421   -65.17362
   60    59 S   HC   _H14   108     1.09467   111.48682   -61.90943
   61    59 S   HC   _H15   109     1.09290   112.06478    60.60920
   62    59 S   HC   _H16   110     1.09597   110.06127  -179.36882
   63    56 S   OH   _O33   111     1.43011   108.59091   173.34636
   64    63 S   HO   _H17   112     0.97233   107.50872  -173.87612
   65    58 S   CT   _C13    47     1.43372   112.40686    63.52040
   66    65 S   HC   _H8_    48     1.09910   107.72865    58.68638
   67    65 S   CT   _C14    49     1.53807   110.54548   -60.81262
   68    67 S   HC   _H9_    50     1.09516   109.91161   -65.74329
   69    65 S   CT   _C16    57     1.54469   108.95461   172.93175
   70    69 S   HC   _H24    58     1.09806   109.22967   -47.18184
   71    69 S   HC   _H25    59     1.09840   107.95559  -161.67307
   72    43 S   CT   _C15    51     1.54323   110.61842  -177.27775
   73    72 S   HC   _H10    52     1.09608   111.40928    49.98868
   74    67 S   OH   _O36    55     1.42474   109.91203   176.38957
   75    74 S   HO   _H23    56     0.97226   107.62171  -174.18331
   76    69 S   CM   _C17    60     1.52192   116.07538    75.15569
   77    72 S   OH   _O35    53     1.43186   108.72413   166.97316
   78    77 S   HO   _H22    54     0.97264   107.49141   -62.41953
   79    76 S   CM   _C18    61     1.34650   118.97834   106.22960
   80    79 S   HC   _H26    62     1.08701   120.22594    -2.22721
   81    76 S   CT   _C29    93     1.50504   115.58536   -73.54643
   82    81 S   HC   _H43    94     1.09483   110.09346   -57.96334
   83    81 S   HC   _H44    95     1.09144   113.87415  -178.56878
   84    81 S   HC   _H45    96     1.09304   110.48794    61.78374
   85    79 S   CO4  _C19    63     1.47716   124.55134  -178.21162
   86    85 S   O    _O37    64     1.21873   125.79599   -44.17855
   87    85 S   OS   _O38    65     1.35894   106.63932   134.31580
   88    87 S   CT   _C20    66     1.43755   116.97390  -171.33685
   89    88 S   HC   _H27    67     1.09613   110.34377   -45.72576
   90    88 S   HC   _H28    68     1.09516   106.98033  -162.10031
   91    88 S   CT   _C21    69     1.52808   110.91188    77.90371
   92    91 S   HC   _H29    70     1.09556   109.04386   -66.84408
   93    91 S   HC   _H30    71     1.09592   109.23976   176.17776
   94    91 S   CT   _C22    72     1.53138   112.58938    53.44162
   95    94 S   HC   _H31    73     1.09649   109.78305    59.19220
   96    94 S   HC   _H32    74     1.09657   109.80184   -58.38098
   97    94 S   CT   _C23    75     1.52894   111.24874  -179.16140
   98    97 S   HC   _H33    76     1.09650   109.76167   -64.08191
   99    97 S   HC   _H34    77     1.09594   109.41706    53.28809
  100    97 S   CT   _C24    78     1.52877   111.26390   173.97426
  101   100 S   HC   _H35    79     1.09699   109.22896   -57.11197
  102   100 S   HC   _H36    80     1.09655   109.90269    60.17007
  103   100 S   CT   _C25    81     1.52895   111.24551  -178.11415
  104   103 S   HC   _H37    82     1.09666   109.73237   -64.02326
  105   103 S   HC   _H38    83     1.09650   109.46302    53.10207
  106   103 S   CT   _C26    84     1.52896   111.23497   174.31942
  107   106 S   HC   _H39    85     1.09725   109.69501    62.49853
  108   106 S   HC   _H40    86     1.09663   109.60705   -53.93584
  109   106 S   CT   _C27    87     1.52417   111.27596  -175.92369
  110   109 S   HC   _H41    88     1.09617   111.04860    52.08693
  111   109 S   HC   _H42    89     1.09583   110.72111   -67.16419
  112   109 S   CO3  _C28    90     1.52647   108.15594   171.70852
  113   112 S   O2Z  _O40    91     1.26275   115.12737    95.72206
  114   112 S   O2Z  _O39    92     1.26399   115.00591   -84.62183
  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  10   5   4   3
  16   8   2   1   1  16   6   5  14   6  13   8  15   9   3   1
  10   4   3   7   3   2   1   7   6  10   5   3   2   1   1   1
  14   8  11   6  12   4   3   5   3   2   1   9   1   1   9   4
   4   2   1   1   6   2   7   9   5   4   9   5   4   9   5   4
   9   5   4   9   5   4   9   5   4   8   5   4   5   4   3   2
   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    41    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    43    41    42    45    47  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    43    44    49    72    41    42    45    46    52    56    47    48  
   38    39    40    43    41    42    45    47  
   36    37  
   37  
    0  
   39    40    43    44    49    50    51    58    67    72    73    77    41    42    45    47  
   40    43    44    49    72    41  
   43    44    49    72    41  
   42    45    46    52    53    54    55    56    57    59    63    47    48    43  
   45    46    52    56    47    48  
   44    49    50    51    58    65    67    68    72    73    77    78    74  
   49    50    51    58    67    72    73    77  
   46    52    53    54    55    56    57    59    60    61    62    63    64    47    48  
   52    53    54    55    56    57    59    63    47  
   48    52    56  
    0  
   50    51    58    65    66    67    72    73    77    69  
   51    58    65    72  
   58    65    72  
   53    54    55    56    57    59    63  
   54    55    56  
   55    56  
   56  
   57    59    60    61    62    63    64  
   59    60    61    62    63    64  
   65    66    67    68    72    74    69    70    71    76  
   60    61    62    63    64  
   61    62    63  
   62    63  
   63  
   64  
    0  
   66    67    68    72    73    77    74    75    69    70    71    76    79    81  
   67    68    72    74    69    70    71    76  
   68    72    73    77    78    74    75    69    70    71    76  
   72    73    77    74    75    69  
   70    71    76    79    80    85    81    82    83    84    72    74  
   71    76    79    81  
   76    79    81  
   73    77    78    74    75  
   77    78    74  
   75    77  
    0  
   79    80    85    86    87    81    82    83    84  
   78  
    0  
   80    85    86    87    88    81    82    83    84  
   85    86    87    81  
   82    83    84    85  
   83    84  
   84  
    0  
   86    87    88    89    90    91  
   87    88  
   88    89    90    91    92    93    94  
   89    90    91    92    93    94    95    96    97  
   90    91    92    93    94  
   91    92    93    94  
   92    93    94    95    96    97    98    99   100  
   93    94    95    96    97  
   94    95    96    97  
   95    96    97    98    99   100   101   102   103  
   96    97    98    99   100  
   97    98    99   100  
   98    99   100   101   102   103   104   105   106  
   99   100   101   102   103  
  100   101   102   103  
  101   102   103   104   105   106   107   108   109  
  102   103   104   105   106  
  103   104   105   106  
  104   105   106   107   108   109   110   111   112  
  105   106   107   108   109  
  106   107   108   109  
  107   108   109   110   111   112   113   114  
  108   109   110   111   112  
  109   110   111   112  
  110   111   112   113   114  
  111   112   113   114  
  112   113   114  
  113   114  
  114  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   48   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   49   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   59   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   64   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   65   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   75   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   76   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   77   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   78   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   79   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   80   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   86   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   87   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   88   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   90   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   91   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  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   3.5000   0.0660  -0.220000   1.9750   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   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
  113   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
  114   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
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   268.000  1.529
   33    41   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    43   268.000  1.529
   43    44   340.000  1.090
   43    49   268.000  1.529
   43    72   268.000  1.529
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    58   320.000  1.410
   58    65   320.000  1.410
   65    66   340.000  1.090
   65    67   268.000  1.529
   65    69   268.000  1.529
   67    68   340.000  1.090
   67    72   268.000  1.529
   67    74   320.000  1.410
   72    73   340.000  1.090
   72    77   320.000  1.410
   77    78   553.000  0.945
   74    75   553.000  0.945
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    76   317.000  1.510
   76    79   549.000  1.340
   76    81   317.000  1.510
   79    80   340.000  1.080
   79    85   320.000  1.462
   85    86   570.000  1.229
   85    87   214.000  1.327
   87    88   320.000  1.410
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    91   268.000  1.529
   91    92   340.000  1.090
   91    93   340.000  1.090
   91    94   268.000  1.529
   94    95   340.000  1.090
   94    96   340.000  1.090
   94    97   268.000  1.529
   97    98   340.000  1.090
   97    99   340.000  1.090
   97   100   268.000  1.529
  100   101   340.000  1.090
  100   102   340.000  1.090
  100   103   268.000  1.529
  103   104   340.000  1.090
  103   105   340.000  1.090
  103   106   268.000  1.529
  106   107   340.000  1.090
  106   108   340.000  1.090
  106   109   268.000  1.529
  109   110   340.000  1.090
  109   111   340.000  1.090
  109   112   317.000  1.522
  112   113   656.000  1.250
  112   114   656.000  1.250
   81    82   340.000  1.090
   81    83   340.000  1.090
   81    84   340.000  1.090
   41    42   340.000  1.090
   41    45   268.000  1.529
   41    47   320.000  1.410
   45    46   340.000  1.090
   45    52   268.000  1.529
   45    56   268.000  1.529
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   340.000  1.090
   56    57   340.000  1.090
   56    59   268.000  1.529
   56    63   320.000  1.410
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   340.000  1.090
   63    64   553.000  0.945
   47    48   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    75.00000  111.63000
   29    33    41    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    43    58.35000  112.70000
   33    41    42    37.50000  110.70000
   33    41    45    58.35000  112.70000
   33    41    47    50.00000  109.50000
   38    33    34    37.50000  110.70000
   38    43    44    37.50000  110.70000
   38    43    49    58.35000  112.70000
   38    43    72    58.35000  112.70000
   40    38    39    33.00000  107.80000
   43    38    39    37.50000  110.70000
   43    38    40    37.50000  110.70000
   43    49    50    37.50000  110.70000
   43    49    51    37.50000  110.70000
   43    49    58    50.00000  109.50000
   43    72    67    58.35000  112.70000
   43    72    73    37.50000  110.70000
   43    72    77    50.00000  109.50000
   49    43    44    37.50000  110.70000
   49    58    65    60.00000  109.50000
   51    49    50    33.00000  107.80000
   58    49    50    35.00000  109.50000
   58    49    51    35.00000  109.50000
   58    65    66    35.00000  109.50000
   58    65    67    50.00000  109.50000
   58    65    69    50.00000  109.50000
   65    67    68    37.50000  110.70000
   65    67    72    58.35000  112.70000
   65    67    74    50.00000  109.50000
   65    69    70    37.50000  110.70000
   65    69    71    37.50000  110.70000
   65    69    76    70.00000  112.02700
   67    65    66    37.50000  110.70000
   67    72    73    37.50000  110.70000
   67    72    77    50.00000  109.50000
   67    74    75    55.00000  108.50000
   72    43    44    37.50000  110.70000
   72    43    49    58.35000  112.70000
   72    67    68    37.50000  110.70000
   72    77    78    55.00000  108.50000
   77    72    73    35.00000  109.50000
   74    67    68    35.00000  109.50000
   74    67    72    50.00000  109.50000
   69    65    66    37.50000  110.70000
   69    65    67    58.35000  112.70000
   69    76    79    70.00000  124.00000
   69    76    81    65.00000  117.92700
   71    69    70    33.00000  107.80000
   76    69    70    35.00000  109.50000
   76    69    71    35.00000  109.50000
   76    79    80    35.00000  120.00000
   76    79    85    65.00000  118.96000
   76    81    82    35.00000  109.50000
   76    81    83    35.00000  109.50000
   76    81    84    35.00000  109.50000
   79    85    86    80.00000  123.72100
   79    85    87    90.00000  111.29400
   85    79    80    40.00000  117.72500
   85    87    88    83.00000  116.90000
   87    85    86    83.00000  123.40000
   87    88    89    35.00000  109.50000
   87    88    90    35.00000  109.50000
   87    88    91    50.00000  109.50000
   88    91    92    37.50000  110.70000
   88    91    93    37.50000  110.70000
   88    91    94    58.35000  112.70000
   90    88    89    33.00000  107.80000
   91    88    89    37.50000  110.70000
   91    88    90    37.50000  110.70000
   91    94    95    37.50000  110.70000
   91    94    96    37.50000  110.70000
   91    94    97    58.35000  112.70000
   93    91    92    33.00000  107.80000
   94    91    92    37.50000  110.70000
   94    91    93    37.50000  110.70000
   94    97    98    37.50000  110.70000
   94    97    99    37.50000  110.70000
   94    97   100    58.35000  112.70000
   96    94    95    33.00000  107.80000
   97    94    95    37.50000  110.70000
   97    94    96    37.50000  110.70000
   97   100   101    37.50000  110.70000
   97   100   102    37.50000  110.70000
   97   100   103    58.35000  112.70000
   99    97    98    33.00000  107.80000
  100    97    98    37.50000  110.70000
  100    97    99    37.50000  110.70000
  100   103   104    37.50000  110.70000
  100   103   105    37.50000  110.70000
  100   103   106    58.35000  112.70000
  102   100   101    33.00000  107.80000
  103   100   101    37.50000  110.70000
  103   100   102    37.50000  110.70000
  103   106   107    37.50000  110.70000
  103   106   108    37.50000  110.70000
  103   106   109    58.35000  112.70000
  105   103   104    33.00000  107.80000
  106   103   104    37.50000  110.70000
  106   103   105    37.50000  110.70000
  106   109   110    37.50000  110.70000
  106   109   111    37.50000  110.70000
  106   109   112    70.00000  109.69300
  108   106   107    33.00000  107.80000
  109   106   107    37.50000  110.70000
  109   106   108    37.50000  110.70000
  109   112   113    70.00000  117.00000
  109   112   114    70.00000  117.00000
  111   109   110    33.00000  107.80000
  112   109   110    35.00000  109.50000
  112   109   111    35.00000  109.50000
  114   112   113    80.00000  126.00000
   81    76    79    70.00000  124.00000
   83    81    82    33.00000  107.80000
   84    81    82    33.00000  107.80000
   84    81    83    33.00000  107.80000
   41    33    34    37.50000  110.70000
   41    33    38    58.35000  112.70000
   41    45    46    37.50000  110.70000
   41    45    52    58.35000  112.70000
   41    45    56    58.35000  112.70000
   41    47    48    55.00000  108.50000
   45    41    42    37.50000  110.70000
   45    52    53    37.50000  110.70000
   45    52    54    37.50000  110.70000
   45    52    55    37.50000  110.70000
   45    56    57    37.50000  110.70000
   45    56    59    58.35000  112.70000
   45    56    63    50.00000  109.50000
   52    45    46    37.50000  110.70000
   54    52    53    33.00000  107.80000
   55    52    53    33.00000  107.80000
   55    52    54    33.00000  107.80000
   56    45    46    37.50000  110.70000
   56    45    52    58.35000  112.70000
   56    59    60    37.50000  110.70000
   56    59    61    37.50000  110.70000
   56    59    62    37.50000  110.70000
   56    63    64    55.00000  108.50000
   59    56    57    37.50000  110.70000
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    33.00000  107.80000
   63    56    57    35.00000  109.50000
   63    56    59    50.00000  109.50000
   47    41    42    35.00000  109.50000
   47    41    45    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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   45    56    63    64  -0.11600  1.0 1.0
   45    56    63    64  -0.09450 -1.0 2.0
   45    56    63    64   0.21250  1.0 3.0
   46    45    52    53   0.15000  1.0 3.0
   46    45    52    54   0.15000  1.0 3.0
   46    45    52    55   0.15000  1.0 3.0
   46    45    56    57   0.15000  1.0 3.0
   46    45    56    59   0.15000  1.0 3.0
   46    45    56    63   0.23400  1.0 3.0
   52    45    56    57   0.15000  1.0 3.0
   52    45    56    59   0.56750  1.0 1.0
   52    45    56    59  -0.07550 -1.0 2.0
   52    45    56    59   0.20000  1.0 3.0
   52    45    56    63   0.86500  1.0 1.0
   52    45    56    63  -0.17500 -1.0 2.0
   52    45    56    63   0.20800  1.0 3.0
   56    45    52    53   0.15000  1.0 3.0
   56    45    52    54   0.15000  1.0 3.0
   56    45    52    55   0.15000  1.0 3.0
   57    56    59    60   0.15000  1.0 3.0
   57    56    59    61   0.15000  1.0 3.0
   57    56    59    62   0.15000  1.0 3.0
   57    56    63    64   0.19450  1.0 3.0
   59    56    63    64  -0.11600  1.0 1.0
   59    56    63    64  -0.09450 -1.0 2.0
   59    56    63    64   0.21250  1.0 3.0
   63    56    59    60   0.23400  1.0 3.0
   63    56    59    61   0.23400  1.0 3.0
   63    56    59    62   0.23400  1.0 3.0
   47    41    45    46   0.23400  1.0 3.0
   47    41    45    52   0.86500  1.0 1.0
   47    41    45    52  -0.17500 -1.0 2.0
   47    41    45    52   0.20800  1.0 3.0
   47    41    45    56   0.86500  1.0 1.0
   47    41    45    56  -0.17500 -1.0 2.0
   47    41    45    56   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
   69    81    76    79  15.00000 -1.0 2.0
   85    80    79    76  15.00000 -1.0 2.0
   79    87    85    86  10.50000 -1.0 2.0
  113   109   112   114  10.50000 -1.0 2.0
END
