* LIGAND DATABASE FILE (OPLS2005)
*
001     117   120    235    384     718
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02116    71.11249    66.81740
    3     1 S   H    _H1_     3     1.02141    42.30306  -141.77008
    4     1 S   H    _H2_     4     1.02081   103.47417   -38.68720
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    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     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04748   118.84952     8.59078
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08457   106.27517   -11.11459
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    33     1.08491   110.56590    58.77998
   26    24 S   HC   HB22    34     1.08612   109.94660   179.13182
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C32    36     1.84367    97.48123  -180.00000
   34    33 S   HC   _H3_    37     1.09450   106.70905  -180.00000
   35    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   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   CT   _C28    38     1.56590   109.84518    63.74257
   39    38 S   HC   _H76    39     1.10012   109.13711   -64.35231
   40    33 S   CT   _C31    95     1.55760   109.78551   -62.44022
   41    40 S   HC   _H79    96     1.09461   107.62684    83.76854
   42    38 S   CT   _C16    40     1.53163   112.76021   175.68861
   43    42 S   HC   _H53    41     1.09811   106.43337    58.64055
   44    38 S   CT   _C24    91     1.53765   111.75827    53.74685
   45    44 S   HC   _H65    92     1.09360   111.81190    60.58553
   46    44 S   HC   _H66    93     1.09588   110.78093   -58.04537
   47    44 S   HC   _H67    94     1.09463   111.10361  -178.07573
   48    40 S   CT   _C30    97     1.57212   118.02084   -36.85078
   49    48 S   HC   _H78    98     1.09808   107.35765    58.56077
   50    40 S   OH   _O35   116     1.43233   108.28661  -161.85265
   51    50 S   HO   _H83   117     0.96746   106.11615  -170.09117
   52    42 S   CT   _C8_    42     1.55356   110.00852   -59.31691
   53    52 S   HC   _H41    43     1.09653   110.35369   130.73981
   54    52 S   HC   _H42    44     1.09524   112.15024    11.74715
   55    48 S   CT   _C27    99     1.54933   110.32163   -58.85390
   56    55 S   HC   _H74   100     1.09476   109.01590    55.98766
   57    55 S   HC   _H75   101     1.09557   110.33235   172.00576
   58    48 S   CT   _C29   106     1.57113   109.03546   173.09828
   59    58 S   HC   _H77   107     1.09718   107.74951    69.85362
   60    52 S   CT   _C6_    45     1.53654   107.35225  -109.94418
   61    60 S   HC   _H37    46     1.09486   111.41048   132.16629
   62    60 S   HC   _H38    47     1.09486   109.66593  -108.90293
   63    55 S   CT   _C23   102     1.52021   115.94241   -62.95941
   64    63 S   HC   _H62   103     1.09276   111.73561   -59.13965
   65    63 S   HC   _H63   104     1.09513   109.82931  -177.30797
   66    63 S   HC   _H64   105     1.09415   111.40789    63.42391
   67    58 S   CT   _C25   108     1.53386   113.21321  -175.33398
   68    67 S   HC   _H68   109     1.09484   110.99723    63.11309
   69    67 S   HC   _H69   110     1.09114   112.96602  -174.79843
   70    67 S   HC   _H70   111     1.09598   109.99423   -55.51548
   71    58 S   CT   _C26   112     1.53046   114.12014   -47.87983
   72    71 S   HC   _H71   113     1.09354   112.08839   -61.43057
   73    71 S   HC   _H72   114     1.09544   110.30021   179.16937
   74    71 S   HC   _H73   115     1.09374   111.40744    60.04495
   75    60 S   CT   _C14    48     1.52273   104.15462    11.45549
   76    75 S   HC   _H51    49     1.10324   105.18119    76.87182
   77    75 S   CT   _C13    50     1.53707   119.31318  -167.11708
   78    77 S   HC   _H50    51     1.09948   103.67803   -90.18465
   79    77 S   CT   _C5_    52     1.53976   117.11022    27.20084
   80    79 S   HC   _H35    53     1.09464   110.97431    57.31468
   81    79 S   HC   _H36    54     1.09440   110.36093   -64.04176
   82    77 S   CT   _C15    70     1.55151   112.01219   153.78777
   83    82 S   HC   _H52    71     1.09490   105.82334   -81.27567
   84    79 S   CO4  _C4_    55     1.52837   110.33060   176.89411
   85    84 S   O    _O30    56     1.22840   121.58159  -170.85849
   86    82 S   CT   _C7_    72     1.53458   111.30562    31.53338
   87    86 S   HC   _H39    73     1.09598   110.68740   178.11612
   88    86 S   HC   _H40    74     1.09627   109.38407    60.65988
   89    84 S   CT   _C12    57     1.52149   115.42928    11.16426
   90    89 S   HC   _H49    58     1.10087   103.42161    56.34529
   91    86 S   CT   _C9_    75     1.54974   113.00413   -60.34674
   92    91 S   HC   _H43    76     1.09242   106.54762   152.82410
   93    91 S   HC   _H44    77     1.09818   108.53726   -94.56434
   94    89 S   CT   _C10    59     1.52573   116.46636   169.34857
   95    94 S   HC   _H45    60     1.09781   110.37037   -48.95791
   96    94 S   HC   _H46    61     1.09479   112.69728    67.66734
   97    42 S   CT   _C19    78     1.56279   116.44738  -177.34561
   98    94 S   CT   _C17    62     1.53476   108.55588  -168.41092
   99    98 S   HC   _H54    63     1.09740   108.26137    66.61799
  100    97 S   CT   _C21    79     1.55498   106.32314  -155.68265
  101   100 S   HC   _H56    80     1.08041   108.45947   -52.60878
  102   100 S   HC   _H57    81     1.07980   108.43695  -172.58640
  103   100 S   HC   _H58    82     1.07997   108.43034    67.38686
  104    98 S   CT   _C18    64     1.53603   113.57075   -53.41232
  105   104 S   HC   _H55    65     1.09666   109.20490   168.72385
  106    98 S   OH   _O33    89     1.42362   110.07151  -176.73397
  107   106 S   HO   _H81    90     0.97019   106.66989   -60.00124
  108   104 S   CT   _C11    66     1.54409   113.31179    47.21606
  109   108 S   HC   _H47    67     1.09806   107.90300    73.44853
  110   108 S   HC   _H48    68     1.09606   108.56230  -170.53070
  111   104 S   OH   _O34    87     1.42661   110.43818   -75.60215
  112   111 S   HO   _H82    88     0.96932   106.51360  -174.78402
  113    89 S   CT   _C20    69     1.55652   110.33901   -59.93441
  114   113 S   CT   _C22    83     1.55493   111.35167   -73.68411
  115   114 S   HC   _H59    84     1.07992   108.45203    62.43436
  116   114 S   HC   _H60    85     1.07947   108.46155   -57.63923
  117   114 S   HC   _H61    86     1.07998   108.44923  -177.62381
  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
  19   8   2   1   1  19   9  15   6  23   9   5   2   1   1  20
   9   3   1  11   6   5  10   6   5  10   8  11   5   4   3   2
   1   1   7   3   2   1   3   2   1   1  19   7  18   9  12   5
   4  21   8  10   4  11   6   5  16   7   8   3   2  12   6   5
   4  11   6   3   2   1   1  10   7   3   1   9   4   3   2   1
   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    42    44    40    41    48    50  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    43    52    97    44    45    46    47    40    41    48    49    55    58    50    51  
   38    39    42    44    40    41    48    50  
   36    37  
   37  
    0  
   39    42    43    52    53    54    60    75    91    97   100    44    45    46    47    40    41    48    50  
   42    43    52    97    44    45    46    47    40  
   41    48    49    55    56    57    63    58    59    67    71    50    51    42    44  
   48    49    55    58    50    51  
   43    52    53    54    60    61    62    75    76    77    86    91    92    93    97   100   101   102   103    44    45    46    47  
   52    53    54    60    75    91    97   100    44  
   45    46    47    52    97  
   46    47  
   47  
    0  
   49    55    56    57    63    64    65    66    58    59    67    68    69    70    71    72    73    74    50    51  
   55    56    57    63    58    59    67    71    50  
   51    55    58  
    0  
   53    54    60    61    62    75    76    77    91    97   100  
   54    60    61    62    75    97  
   60    61    62    75    97  
   56    57    63    64    65    66    58    59    67    71  
   57    63    64    65    66    58  
   63    64    65    66    58  
   59    67    68    69    70    71    72    73    74    63  
   67    68    69    70    71    72    73    74  
   61    62    75    76    77    78    79    82    91    97   100  
   62    75    76    77    97  
   75    76    77    97  
   64    65    66  
   65    66  
   66  
    0  
   68    69    70    71    72    73    74  
   69    70    71  
   70    71  
   71  
   72    73    74  
   73    74  
   74  
    0  
   76    77    78    79    80    81    84   113    82    83    86    91    92    93    97   100   101   102   103  
   77    78    79    82    91    97   100  
   78    79    80    81    84    85    89   108   113    82    83    86    87    88    91    97   100   114  
   79    80    81    84   113    82    83    86    97  
   80    81    84    85    89    90    94   113    82    83    86    97  
   81    84    85    89    82  
   84    85    89    82  
   83    86    87    88    91    92    93    97   114   115   116   117    84    89    90    94   104   108   109   110   113  
   86    87    88    91   114    89   108   113  
   85    89    90    94    95    96    98   108   113   114  
   89    90    94   113  
   87    88    91    92    93    97   100   114    89   108   113  
   88    91    92    93    97   113  
   91    92    93    97   113  
   90    94    95    96    98    99   104   108   109   110   113   114   115   116   117   106  
   94    95    96    98   108   113   114  
   92    93    97   100   101   102   103   113  
   93    97   100  
   97   100  
   95    96    98    99   104   105   108   113   114   111   106   107  
   96    98    99   104   113   106  
   98    99   104   113   106  
  100   101   102   103  
   99   104   105   108   109   110   113   111   112   106   107  
  104   105   108   111   106   107  
  101   102   103  
  102   103  
  103  
    0  
  105   108   109   110   113   114   111   112   106   107  
  108   109   110   113   111   112   106  
  107   108   111  
    0  
  109   110   113   114   115   116   117   111   112  
  110   113   114   111  
  113   114   111  
  112   113  
    0  
  114   115   116   117  
  115   116   117  
  116   117  
  117  
    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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   51   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   52   3.5000   0.0660  -0.120000   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   85   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   86   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.4200   0.0150   0.060000   1.4250   1.2500   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   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   98   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
  105   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  107   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  108   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  112   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  113   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
  114   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  115   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  116   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  117   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   268.000  1.529
   33    40   268.000  1.529
   38    39   340.000  1.090
   38    42   268.000  1.529
   38    44   268.000  1.529
   42    43   340.000  1.090
   42    52   268.000  1.529
   42    97   268.000  1.529
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    60   268.000  1.529
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    75   268.000  1.529
   75    76   340.000  1.090
   75    77   268.000  1.529
   75    97   268.000  1.529
   77    78   340.000  1.090
   77    79   268.000  1.529
   77    82   268.000  1.529
   79    80   340.000  1.090
   79    81   340.000  1.090
   79    84   317.000  1.522
   84    85   570.000  1.229
   84    89   317.000  1.522
   89    90   340.000  1.090
   89    94   268.000  1.529
   89   113   268.000  1.529
   94    95   340.000  1.090
   94    96   340.000  1.090
   94    98   268.000  1.529
   98    99   340.000  1.090
   98   104   268.000  1.529
   98   106   320.000  1.410
  104   105   340.000  1.090
  104   108   268.000  1.529
  104   111   320.000  1.410
  108   109   340.000  1.090
  108   110   340.000  1.090
  108   113   268.000  1.529
  113    82   268.000  1.529
  113   114   268.000  1.529
   82    83   340.000  1.090
   82    86   268.000  1.529
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    91   268.000  1.529
   91    92   340.000  1.090
   91    93   340.000  1.090
   91    97   268.000  1.529
   97   100   268.000  1.529
  100   101   340.000  1.090
  100   102   340.000  1.090
  100   103   340.000  1.090
  114   115   340.000  1.090
  114   116   340.000  1.090
  114   117   340.000  1.090
  111   112   553.000  0.945
  106   107   553.000  0.945
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   340.000  1.090
   40    41   340.000  1.090
   40    48   268.000  1.529
   40    50   320.000  1.410
   48    49   340.000  1.090
   48    55   268.000  1.529
   48    58   268.000  1.529
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    63   268.000  1.529
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   340.000  1.090
   58    59   340.000  1.090
   58    67   268.000  1.529
   58    71   268.000  1.529
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   340.000  1.090
   50    51   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    40    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    42    58.35000  112.70000
   33    38    44    58.35000  112.70000
   33    40    41    37.50000  110.70000
   33    40    48    58.35000  112.70000
   33    40    50    50.00000  109.50000
   38    33    34    37.50000  110.70000
   38    42    43    37.50000  110.70000
   38    42    52    58.35000  112.70000
   38    42    97    58.35000  112.70000
   38    44    45    37.50000  110.70000
   38    44    46    37.50000  110.70000
   38    44    47    37.50000  110.70000
   42    38    39    37.50000  110.70000
   42    52    53    37.50000  110.70000
   42    52    54    37.50000  110.70000
   42    52    60    58.35000  112.70000
   42    97    75    58.35000  112.70000
   42    97    91    58.35000  112.70000
   42    97   100    58.35000  112.70000
   52    42    43    37.50000  110.70000
   52    60    61    37.50000  110.70000
   52    60    62    37.50000  110.70000
   52    60    75    58.35000  112.70000
   54    52    53    33.00000  107.80000
   60    52    53    37.50000  110.70000
   60    52    54    37.50000  110.70000
   60    75    76    37.50000  110.70000
   60    75    77    58.35000  112.70000
   60    75    97    58.35000  112.70000
   62    60    61    33.00000  107.80000
   75    60    61    37.50000  110.70000
   75    60    62    37.50000  110.70000
   75    77    78    37.50000  110.70000
   75    77    79    58.35000  112.70000
   75    77    82    58.35000  112.70000
   75    97    91    58.35000  112.70000
   75    97   100    58.35000  112.70000
   77    75    76    37.50000  110.70000
   77    79    80    37.50000  110.70000
   77    79    81    37.50000  110.70000
   77    79    84    63.00000  111.10000
   77    82   113    58.35000  112.70000
   77    82    83    37.50000  110.70000
   77    82    86    58.35000  112.70000
   79    77    78    37.50000  110.70000
   79    84    85    80.00000  120.40000
   79    84    89    70.00000  116.00000
   81    79    80    33.00000  107.80000
   84    79    80    35.00000  109.50000
   84    79    81    35.00000  109.50000
   84    89    90    35.00000  109.50000
   84    89    94    63.00000  111.10000
   84    89   113    63.00000  111.10000
   89    84    85    80.00000  120.40000
   89    94    95    37.50000  110.70000
   89    94    96    37.50000  110.70000
   89    94    98    58.35000  112.70000
   89   113   108    58.35000  112.70000
   89   113    82    58.35000  112.70000
   89   113   114    58.35000  112.70000
   94    89    90    37.50000  110.70000
   94    98    99    37.50000  110.70000
   94    98   104    58.35000  112.70000
   94    98   106    50.00000  109.50000
   96    94    95    33.00000  107.80000
   98    94    95    37.50000  110.70000
   98    94    96    37.50000  110.70000
   98   104   105    37.50000  110.70000
   98   104   108    58.35000  112.70000
   98   104   111    50.00000  109.50000
   98   106   107    55.00000  108.50000
  104    98    99    37.50000  110.70000
  104   108   109    37.50000  110.70000
  104   108   110    37.50000  110.70000
  104   108   113    58.35000  112.70000
  104   111   112    55.00000  108.50000
  108   104   105    37.50000  110.70000
  108   113    82    58.35000  112.70000
  108   113   114    58.35000  112.70000
  110   108   109    33.00000  107.80000
  113    89    90    37.50000  110.70000
  113    89    94    58.35000  112.70000
  113   108   109    37.50000  110.70000
  113   108   110    37.50000  110.70000
  113    82    83    37.50000  110.70000
  113    82    86    58.35000  112.70000
  113   114   115    37.50000  110.70000
  113   114   116    37.50000  110.70000
  113   114   117    37.50000  110.70000
   82    77    78    37.50000  110.70000
   82    77    79    58.35000  112.70000
   82    86    87    37.50000  110.70000
   82    86    88    37.50000  110.70000
   82    86    91    58.35000  112.70000
   86    82    83    37.50000  110.70000
   86    91    92    37.50000  110.70000
   86    91    93    37.50000  110.70000
   86    91    97    58.35000  112.70000
   88    86    87    33.00000  107.80000
   91    86    87    37.50000  110.70000
   91    86    88    37.50000  110.70000
   91    97   100    58.35000  112.70000
   93    91    92    33.00000  107.80000
   97    42    43    37.50000  110.70000
   97    42    52    58.35000  112.70000
   97    75    76    37.50000  110.70000
   97    75    77    58.35000  112.70000
   97    91    92    37.50000  110.70000
   97    91    93    37.50000  110.70000
   97   100   101    37.50000  110.70000
   97   100   102    37.50000  110.70000
   97   100   103    37.50000  110.70000
  102   100   101    33.00000  107.80000
  103   100   101    33.00000  107.80000
  103   100   102    33.00000  107.80000
  114   113    82    58.35000  112.70000
  116   114   115    33.00000  107.80000
  117   114   115    33.00000  107.80000
  117   114   116    33.00000  107.80000
  111   104   105    35.00000  109.50000
  111   104   108    50.00000  109.50000
  106    98    99    35.00000  109.50000
  106    98   104    50.00000  109.50000
   44    38    39    37.50000  110.70000
   44    38    42    58.35000  112.70000
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    33.00000  107.80000
   40    33    34    37.50000  110.70000
   40    33    38    58.35000  112.70000
   40    48    49    37.50000  110.70000
   40    48    55    58.35000  112.70000
   40    48    58    58.35000  112.70000
   40    50    51    55.00000  108.50000
   48    40    41    37.50000  110.70000
   48    55    56    37.50000  110.70000
   48    55    57    37.50000  110.70000
   48    55    63    58.35000  112.70000
   48    58    59    37.50000  110.70000
   48    58    67    58.35000  112.70000
   48    58    71    58.35000  112.70000
   55    48    49    37.50000  110.70000
   55    63    64    37.50000  110.70000
   55    63    65    37.50000  110.70000
   55    63    66    37.50000  110.70000
   57    55    56    33.00000  107.80000
   63    55    56    37.50000  110.70000
   63    55    57    37.50000  110.70000
   65    63    64    33.00000  107.80000
   66    63    64    33.00000  107.80000
   66    63    65    33.00000  107.80000
   58    48    49    37.50000  110.70000
   58    48    55    58.35000  112.70000
   58    67    68    37.50000  110.70000
   58    67    69    37.50000  110.70000
   58    67    70    37.50000  110.70000
   58    71    72    37.50000  110.70000
   58    71    73    37.50000  110.70000
   58    71    74    37.50000  110.70000
   67    58    59    37.50000  110.70000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   71    58    59    37.50000  110.70000
   71    58    67    58.35000  112.70000
   73    71    72    33.00000  107.80000
   74    71    72    33.00000  107.80000
   74    71    73    33.00000  107.80000
   50    40    41    35.00000  109.50000
   50    40    48    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
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    42   0.44750  1.0 1.0
   29    33    38    42  -0.17800 -1.0 2.0
   29    33    38    42   0.20200  1.0 3.0
   29    33    38    44   0.44750  1.0 1.0
   29    33    38    44  -0.17800 -1.0 2.0
   29    33    38    44   0.20200  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    48   0.44750  1.0 1.0
   29    33    40    48  -0.17800 -1.0 2.0
   29    33    40    48   0.20200  1.0 3.0
   29    33    40    50   0.56750  1.0 1.0
   29    33    40    50  -0.07550 -1.0 2.0
   29    33    40    50   0.20000  1.0 3.0
   33    38    42    43   0.15000  1.0 3.0
   33    38    42    52   0.56750  1.0 1.0
   33    38    42    52  -0.07550 -1.0 2.0
   33    38    42    52   0.20000  1.0 3.0
   33    38    42    97   0.56750  1.0 1.0
   33    38    42    97  -0.07550 -1.0 2.0
   33    38    42    97   0.20000  1.0 3.0
   33    38    44    45   0.15000  1.0 3.0
   33    38    44    46   0.15000  1.0 3.0
   33    38    44    47   0.15000  1.0 3.0
   33    40    48    49   0.15000  1.0 3.0
   33    40    48    55   0.56750  1.0 1.0
   33    40    48    55  -0.07550 -1.0 2.0
   33    40    48    55   0.20000  1.0 3.0
   33    40    48    58   0.56750  1.0 1.0
   33    40    48    58  -0.07550 -1.0 2.0
   33    40    48    58   0.20000  1.0 3.0
   33    40    50    51  -0.11600  1.0 1.0
   33    40    50    51  -0.09450 -1.0 2.0
   33    40    50    51   0.21250  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    42   0.15000  1.0 3.0
   34    33    38    44   0.15000  1.0 3.0
   34    33    40    41   0.15000  1.0 3.0
   34    33    40    48   0.15000  1.0 3.0
   34    33    40    50   0.23400  1.0 3.0
   38    33    40    41   0.15000  1.0 3.0
   38    33    40    48   0.56750  1.0 1.0
   38    33    40    48  -0.07550 -1.0 2.0
   38    33    40    48   0.20000  1.0 3.0
   38    33    40    50   0.86500  1.0 1.0
   38    33    40    50  -0.17500 -1.0 2.0
   38    33    40    50   0.20800  1.0 3.0
   38    42    52    53   0.15000  1.0 3.0
   38    42    52    54   0.15000  1.0 3.0
   38    42    52    60   0.56750  1.0 1.0
   38    42    52    60  -0.07550 -1.0 2.0
   38    42    52    60   0.20000  1.0 3.0
   38    42    97    75   0.56750  1.0 1.0
   38    42    97    75  -0.07550 -1.0 2.0
   38    42    97    75   0.20000  1.0 3.0
   38    42    97    91   0.56750  1.0 1.0
   38    42    97    91  -0.07550 -1.0 2.0
   38    42    97    91   0.20000  1.0 3.0
   38    42    97   100   0.56750  1.0 1.0
   38    42    97   100  -0.07550 -1.0 2.0
   38    42    97   100   0.20000  1.0 3.0
   39    38    42    43   0.15000  1.0 3.0
   39    38    42    52   0.15000  1.0 3.0
   39    38    42    97   0.15000  1.0 3.0
   39    38    44    45   0.15000  1.0 3.0
   39    38    44    46   0.15000  1.0 3.0
   39    38    44    47   0.15000  1.0 3.0
   42    38    44    45   0.15000  1.0 3.0
   42    38    44    46   0.15000  1.0 3.0
   42    38    44    47   0.15000  1.0 3.0
   42    52    60    61   0.15000  1.0 3.0
   42    52    60    62   0.15000  1.0 3.0
   42    52   -60    75   0.56750  1.0 1.0
   42    52   -60    75  -0.07550 -1.0 2.0
   42    52   -60    75   0.20000  1.0 3.0
   42    97   100   101   0.15000  1.0 3.0
   42    97   100   102   0.15000  1.0 3.0
   42    97   100   103   0.15000  1.0 3.0
   43    42    52    53   0.15000  1.0 3.0
   43    42    52    54   0.15000  1.0 3.0
   43    42    52    60   0.15000  1.0 3.0
   43    42    97    75   0.15000  1.0 3.0
   43    42    97    91   0.15000  1.0 3.0
   43    42    97   100   0.15000  1.0 3.0
   52    42   -97    75   0.56750  1.0 1.0
   52    42   -97    75  -0.07550 -1.0 2.0
   52    42   -97    75   0.20000  1.0 3.0
   52    42    97    91   0.56750  1.0 1.0
   52    42    97    91  -0.07550 -1.0 2.0
   52    42    97    91   0.20000  1.0 3.0
   52    42    97   100   0.56750  1.0 1.0
   52    42    97   100  -0.07550 -1.0 2.0
   52    42    97   100   0.20000  1.0 3.0
   52    60    75    76   0.15000  1.0 3.0
   52    60    75    77   0.56750  1.0 1.0
   52    60    75    77  -0.07550 -1.0 2.0
   52    60    75    77   0.20000  1.0 3.0
   52    60   -75    97   0.56750  1.0 1.0
   52    60   -75    97  -0.07550 -1.0 2.0
   52    60   -75    97   0.20000  1.0 3.0
   53    52    60    61   0.15000  1.0 3.0
   53    52    60    62   0.15000  1.0 3.0
   53    52    60    75   0.15000  1.0 3.0
   54    52    60    61   0.15000  1.0 3.0
   54    52    60    62   0.15000  1.0 3.0
   54    52    60    75   0.15000  1.0 3.0
   60    75    77    78   0.15000  1.0 3.0
   60    75    77    79   0.56750  1.0 1.0
   60    75    77    79  -0.07550 -1.0 2.0
   60    75    77    79   0.20000  1.0 3.0
   60    75    77    82   0.56750  1.0 1.0
   60    75    77    82  -0.07550 -1.0 2.0
   60    75    77    82   0.20000  1.0 3.0
   60    75   -97    42   0.56750  1.0 1.0
   60    75   -97    42  -0.07550 -1.0 2.0
   60    75   -97    42   0.20000  1.0 3.0
   60    75    97    91   0.56750  1.0 1.0
   60    75    97    91  -0.07550 -1.0 2.0
   60    75    97    91   0.20000  1.0 3.0
   60    75    97   100   0.56750  1.0 1.0
   60    75    97   100  -0.07550 -1.0 2.0
   60    75    97   100   0.20000  1.0 3.0
   61    60    75    76   0.15000  1.0 3.0
   61    60    75    77   0.15000  1.0 3.0
   61    60    75    97   0.15000  1.0 3.0
   62    60    75    76   0.15000  1.0 3.0
   62    60    75    77   0.15000  1.0 3.0
   62    60    75    97   0.15000  1.0 3.0
   75    77    79    80   0.15000  1.0 3.0
   75    77    79    81   0.15000  1.0 3.0
   75    77    79    84  -0.95700  1.0 1.0
   75    77    79    84  -0.18200 -1.0 2.0
   75    77    79    84   0.29450  1.0 3.0
   75    77    82   113   0.56750  1.0 1.0
   75    77    82   113  -0.07550 -1.0 2.0
   75    77    82   113   0.20000  1.0 3.0
   75    77    82    83   0.15000  1.0 3.0
   75    77    82    86   0.56750  1.0 1.0
   75    77    82    86  -0.07550 -1.0 2.0
   75    77    82    86   0.20000  1.0 3.0
   75    97   100   101   0.15000  1.0 3.0
   75    97   100   102   0.15000  1.0 3.0
   75    97   100   103   0.15000  1.0 3.0
   76    75    77    78   0.15000  1.0 3.0
   76    75    77    79   0.15000  1.0 3.0
   76    75    77    82   0.15000  1.0 3.0
   76    75    97    42   0.15000  1.0 3.0
   76    75    97    91   0.15000  1.0 3.0
   76    75    97   100   0.15000  1.0 3.0
   77    75    97    42   0.56750  1.0 1.0
   77    75    97    42  -0.07550 -1.0 2.0
   77    75    97    42   0.20000  1.0 3.0
   77    75    97    91   0.56750  1.0 1.0
   77    75    97    91  -0.07550 -1.0 2.0
   77    75    97    91   0.20000  1.0 3.0
   77    75    97   100   0.56750  1.0 1.0
   77    75    97   100  -0.07550 -1.0 2.0
   77    75    97   100   0.20000  1.0 3.0
   77    79    84    85   0.30150 -1.0 2.0
   77    79    84    89   0.60050  1.0 1.0
   77    79    84    89   0.05600 -1.0 2.0
   77    79    84    89   0.26150  1.0 3.0
   77    82    86    87   0.15000  1.0 3.0
   77    82    86    88   0.15000  1.0 3.0
   77    82   -86    91   0.56750  1.0 1.0
   77    82   -86    91  -0.07550 -1.0 2.0
   77    82   -86    91   0.20000  1.0 3.0
   78    77    79    80   0.15000  1.0 3.0
   78    77    79    81   0.15000  1.0 3.0
   78    77    79    84  -0.11250  1.0 3.0
   78    77    82   113   0.15000  1.0 3.0
   78    77    82    83   0.15000  1.0 3.0
   78    77    82    86   0.15000  1.0 3.0
   79    77    82   113   0.56750  1.0 1.0
   79    77    82   113  -0.07550 -1.0 2.0
   79    77    82   113   0.20000  1.0 3.0
   79    77    82    83   0.15000  1.0 3.0
   79    77    82    86   0.56750  1.0 1.0
   79    77    82    86  -0.07550 -1.0 2.0
   79    77    82    86   0.20000  1.0 3.0
   79    84    89    90   0.00000  1.0 1.0
   79    84    89    94   0.60050  1.0 1.0
   79    84    89    94   0.05600 -1.0 2.0
   79    84    89    94   0.26150  1.0 3.0
   79    84   -89   113   0.60050  1.0 1.0
   79    84   -89   113   0.05600 -1.0 2.0
   79    84   -89   113   0.26150  1.0 3.0
   80    79    84    85   0.00000  1.0 1.0
   80    79    84    89   0.00000  1.0 1.0
   81    79    84    85   0.00000  1.0 1.0
   81    79    84    89   0.00000  1.0 1.0
   84    89    94    95  -0.11250  1.0 3.0
   84    89    94    96  -0.11250  1.0 3.0
   84    89    94    98  -0.95700  1.0 1.0
   84    89    94    98  -0.18200 -1.0 2.0
   84    89    94    98   0.29450  1.0 3.0
   84    89   113   108  -0.95700  1.0 1.0
   84    89   113   108  -0.18200 -1.0 2.0
   84    89   113   108   0.29450  1.0 3.0
   84    89   113    82  -0.95700  1.0 1.0
   84    89   113    82  -0.18200 -1.0 2.0
   84    89   113    82   0.29450  1.0 3.0
   84    89   113   114  -0.95700  1.0 1.0
   84    89   113   114  -0.18200 -1.0 2.0
   84    89   113   114   0.29450  1.0 3.0
   85    84    89    90   0.00000  1.0 1.0
   85    84    89    94   0.30150 -1.0 2.0
   85    84    89   113   0.30150 -1.0 2.0
   89    94    98    99   0.15000  1.0 3.0
   89    94    98   104   0.56750  1.0 1.0
   89    94    98   104  -0.07550 -1.0 2.0
   89    94    98   104   0.20000  1.0 3.0
   89    94    98   106   0.86500  1.0 1.0
   89    94    98   106  -0.17500 -1.0 2.0
   89    94    98   106   0.20800  1.0 3.0
   89   113   -82    77   0.56750  1.0 1.0
   89   113   -82    77  -0.07550 -1.0 2.0
   89   113   -82    77   0.20000  1.0 3.0
   89   113    82    83   0.15000  1.0 3.0
   89   113    82    86   0.56750  1.0 1.0
   89   113    82    86  -0.07550 -1.0 2.0
   89   113    82    86   0.20000  1.0 3.0
   89   113   114   115   0.15000  1.0 3.0
   89   113   114   116   0.15000  1.0 3.0
   89   113   114   117   0.15000  1.0 3.0
   90    89    94    95   0.15000  1.0 3.0
   90    89    94    96   0.15000  1.0 3.0
   90    89    94    98   0.15000  1.0 3.0
   90    89   113   108   0.15000  1.0 3.0
   90    89   113    82   0.15000  1.0 3.0
   90    89   113   114   0.15000  1.0 3.0
   94    89   113   108   0.56750  1.0 1.0
   94    89   113   108  -0.07550 -1.0 2.0
   94    89   113   108   0.20000  1.0 3.0
   94    89   113    82   0.56750  1.0 1.0
   94    89   113    82  -0.07550 -1.0 2.0
   94    89   113    82   0.20000  1.0 3.0
   94    89   113   114   0.56750  1.0 1.0
   94    89   113   114  -0.07550 -1.0 2.0
   94    89   113   114   0.20000  1.0 3.0
   94    98   104   105   0.15000  1.0 3.0
   94    98  -104   108   0.56750  1.0 1.0
   94    98  -104   108  -0.07550 -1.0 2.0
   94    98  -104   108   0.20000  1.0 3.0
   94    98   104   111   0.86500  1.0 1.0
   94    98   104   111  -0.17500 -1.0 2.0
   94    98   104   111   0.20800  1.0 3.0
   94    98   106   107  -0.11600  1.0 1.0
   94    98   106   107  -0.09450 -1.0 2.0
   94    98   106   107   0.21250  1.0 3.0
   95    94    98    99   0.15000  1.0 3.0
   95    94    98   104   0.15000  1.0 3.0
   95    94    98   106   0.23400  1.0 3.0
   96    94    98    99   0.15000  1.0 3.0
   96    94    98   104   0.15000  1.0 3.0
   96    94    98   106   0.23400  1.0 3.0
   98   104   108   109   0.15000  1.0 3.0
   98   104   108   110   0.15000  1.0 3.0
   98   104   108   113   0.56750  1.0 1.0
   98   104   108   113  -0.07550 -1.0 2.0
   98   104   108   113   0.20000  1.0 3.0
   98   104   111   112  -0.11600  1.0 1.0
   98   104   111   112  -0.09450 -1.0 2.0
   98   104   111   112   0.21250  1.0 3.0
   99    98   104   105   0.15000  1.0 3.0
   99    98   104   108   0.15000  1.0 3.0
   99    98   104   111   0.23400  1.0 3.0
   99    98   106   107   0.19450  1.0 3.0
  104    98   106   107  -0.11600  1.0 1.0
  104    98   106   107  -0.09450 -1.0 2.0
  104    98   106   107   0.21250  1.0 3.0
  104   108  -113    89   0.56750  1.0 1.0
  104   108  -113    89  -0.07550 -1.0 2.0
  104   108  -113    89   0.20000  1.0 3.0
  104   108   113    82   0.56750  1.0 1.0
  104   108   113    82  -0.07550 -1.0 2.0
  104   108   113    82   0.20000  1.0 3.0
  104   108   113   114   0.56750  1.0 1.0
  104   108   113   114  -0.07550 -1.0 2.0
  104   108   113   114   0.20000  1.0 3.0
  105   104   108   109   0.15000  1.0 3.0
  105   104   108   110   0.15000  1.0 3.0
  105   104   108   113   0.15000  1.0 3.0
  105   104   111   112   0.19450  1.0 3.0
  108   104   111   112  -0.11600  1.0 1.0
  108   104   111   112  -0.09450 -1.0 2.0
  108   104   111   112   0.21250  1.0 3.0
  108   113    82    77   0.56750  1.0 1.0
  108   113    82    77  -0.07550 -1.0 2.0
  108   113    82    77   0.20000  1.0 3.0
  108   113    82    83   0.15000  1.0 3.0
  108   113    82    86   0.56750  1.0 1.0
  108   113    82    86  -0.07550 -1.0 2.0
  108   113    82    86   0.20000  1.0 3.0
  108   113   114   115   0.15000  1.0 3.0
  108   113   114   116   0.15000  1.0 3.0
  108   113   114   117   0.15000  1.0 3.0
  109   108   113    89   0.15000  1.0 3.0
  109   108   113    82   0.15000  1.0 3.0
  109   108   113   114   0.15000  1.0 3.0
  110   108   113    89   0.15000  1.0 3.0
  110   108   113    82   0.15000  1.0 3.0
  110   108   113   114   0.15000  1.0 3.0
  113    89    94    95   0.15000  1.0 3.0
  113    89    94    96   0.15000  1.0 3.0
  113    89   -94    98   0.56750  1.0 1.0
  113    89   -94    98  -0.07550 -1.0 2.0
  113    89   -94    98   0.20000  1.0 3.0
  113    82    86    87   0.15000  1.0 3.0
  113    82    86    88   0.15000  1.0 3.0
  113    82    86    91   0.56750  1.0 1.0
  113    82    86    91  -0.07550 -1.0 2.0
  113    82    86    91   0.20000  1.0 3.0
   82    77    79    80   0.15000  1.0 3.0
   82    77    79    81   0.15000  1.0 3.0
   82    77   -79    84  -0.95700  1.0 1.0
   82    77   -79    84  -0.18200 -1.0 2.0
   82    77   -79    84   0.29450  1.0 3.0
   82   113   114   115   0.15000  1.0 3.0
   82   113   114   116   0.15000  1.0 3.0
   82   113   114   117   0.15000  1.0 3.0
   82    86    91    92   0.15000  1.0 3.0
   82    86    91    93   0.15000  1.0 3.0
   82    86    91    97   0.56750  1.0 1.0
   82    86    91    97  -0.07550 -1.0 2.0
   82    86    91    97   0.20000  1.0 3.0
   83    82    86    87   0.15000  1.0 3.0
   83    82    86    88   0.15000  1.0 3.0
   83    82    86    91   0.15000  1.0 3.0
   86    91    97    42   0.56750  1.0 1.0
   86    91    97    42  -0.07550 -1.0 2.0
   86    91    97    42   0.20000  1.0 3.0
   86    91   -97    75   0.56750  1.0 1.0
   86    91   -97    75  -0.07550 -1.0 2.0
   86    91   -97    75   0.20000  1.0 3.0
   86    91    97   100   0.56750  1.0 1.0
   86    91    97   100  -0.07550 -1.0 2.0
   86    91    97   100   0.20000  1.0 3.0
   87    86    91    92   0.15000  1.0 3.0
   87    86    91    93   0.15000  1.0 3.0
   87    86    91    97   0.15000  1.0 3.0
   88    86    91    92   0.15000  1.0 3.0
   88    86    91    93   0.15000  1.0 3.0
   88    86    91    97   0.15000  1.0 3.0
   91    97   100   101   0.15000  1.0 3.0
   91    97   100   102   0.15000  1.0 3.0
   91    97   100   103   0.15000  1.0 3.0
   92    91    97    42   0.15000  1.0 3.0
   92    91    97    75   0.15000  1.0 3.0
   92    91    97   100   0.15000  1.0 3.0
   93    91    97    42   0.15000  1.0 3.0
   93    91    97    75   0.15000  1.0 3.0
   93    91    97   100   0.15000  1.0 3.0
   97    42    52    53   0.15000  1.0 3.0
   97    42    52    54   0.15000  1.0 3.0
   97    42   -52    60   0.56750  1.0 1.0
   97    42   -52    60  -0.07550 -1.0 2.0
   97    42   -52    60   0.20000  1.0 3.0
   97    75    77    78   0.15000  1.0 3.0
   97    75    77    79   0.56750  1.0 1.0
   97    75    77    79  -0.07550 -1.0 2.0
   97    75    77    79   0.20000  1.0 3.0
   97    75   -77    82   0.56750  1.0 1.0
   97    75   -77    82  -0.07550 -1.0 2.0
   97    75   -77    82   0.20000  1.0 3.0
  114   113    82    77   0.56750  1.0 1.0
  114   113    82    77  -0.07550 -1.0 2.0
  114   113    82    77   0.20000  1.0 3.0
  114   113    82    83   0.15000  1.0 3.0
  114   113    82    86   0.56750  1.0 1.0
  114   113    82    86  -0.07550 -1.0 2.0
  114   113    82    86   0.20000  1.0 3.0
  111   104   108   109   0.23400  1.0 3.0
  111   104   108   110   0.23400  1.0 3.0
  111   104   108   113   0.86500  1.0 1.0
  111   104   108   113  -0.17500 -1.0 2.0
  111   104   108   113   0.20800  1.0 3.0
  106    98   104   105   0.23400  1.0 3.0
  106    98   104   108   0.86500  1.0 1.0
  106    98   104   108  -0.17500 -1.0 2.0
  106    98   104   108   0.20800  1.0 3.0
  106    98   104   111   3.75450  1.0 1.0
   44    38    42    43   0.15000  1.0 3.0
   44    38    42    52   0.56750  1.0 1.0
   44    38    42    52  -0.07550 -1.0 2.0
   44    38    42    52   0.20000  1.0 3.0
   44    38    42    97   0.56750  1.0 1.0
   44    38    42    97  -0.07550 -1.0 2.0
   44    38    42    97   0.20000  1.0 3.0
   40    33    38    39   0.15000  1.0 3.0
   40    33    38    42   0.56750  1.0 1.0
   40    33    38    42  -0.07550 -1.0 2.0
   40    33    38    42   0.20000  1.0 3.0
   40    33    38    44   0.56750  1.0 1.0
   40    33    38    44  -0.07550 -1.0 2.0
   40    33    38    44   0.20000  1.0 3.0
   40    48    55    56   0.15000  1.0 3.0
   40    48    55    57   0.15000  1.0 3.0
   40    48    55    63   0.56750  1.0 1.0
   40    48    55    63  -0.07550 -1.0 2.0
   40    48    55    63   0.20000  1.0 3.0
   40    48    58    59   0.15000  1.0 3.0
   40    48    58    67   0.56750  1.0 1.0
   40    48    58    67  -0.07550 -1.0 2.0
   40    48    58    67   0.20000  1.0 3.0
   40    48    58    71   0.56750  1.0 1.0
   40    48    58    71  -0.07550 -1.0 2.0
   40    48    58    71   0.20000  1.0 3.0
   41    40    48    49   0.15000  1.0 3.0
   41    40    48    55   0.15000  1.0 3.0
   41    40    48    58   0.15000  1.0 3.0
   41    40    50    51   0.19450  1.0 3.0
   48    40    50    51  -0.11600  1.0 1.0
   48    40    50    51  -0.09450 -1.0 2.0
   48    40    50    51   0.21250  1.0 3.0
   48    55    63    64   0.15000  1.0 3.0
   48    55    63    65   0.15000  1.0 3.0
   48    55    63    66   0.15000  1.0 3.0
   48    58    67    68   0.15000  1.0 3.0
   48    58    67    69   0.15000  1.0 3.0
   48    58    67    70   0.15000  1.0 3.0
   48    58    71    72   0.15000  1.0 3.0
   48    58    71    73   0.15000  1.0 3.0
   48    58    71    74   0.15000  1.0 3.0
   49    48    55    56   0.15000  1.0 3.0
   49    48    55    57   0.15000  1.0 3.0
   49    48    55    63   0.15000  1.0 3.0
   49    48    58    59   0.15000  1.0 3.0
   49    48    58    67   0.15000  1.0 3.0
   49    48    58    71   0.15000  1.0 3.0
   55    48    58    59   0.15000  1.0 3.0
   55    48    58    67   0.56750  1.0 1.0
   55    48    58    67  -0.07550 -1.0 2.0
   55    48    58    67   0.20000  1.0 3.0
   55    48    58    71   0.56750  1.0 1.0
   55    48    58    71  -0.07550 -1.0 2.0
   55    48    58    71   0.20000  1.0 3.0
   56    55    63    64   0.15000  1.0 3.0
   56    55    63    65   0.15000  1.0 3.0
   56    55    63    66   0.15000  1.0 3.0
   57    55    63    64   0.15000  1.0 3.0
   57    55    63    65   0.15000  1.0 3.0
   57    55    63    66   0.15000  1.0 3.0
   58    48    55    56   0.15000  1.0 3.0
   58    48    55    57   0.15000  1.0 3.0
   58    48    55    63   0.56750  1.0 1.0
   58    48    55    63  -0.07550 -1.0 2.0
   58    48    55    63   0.20000  1.0 3.0
   59    58    67    68   0.15000  1.0 3.0
   59    58    67    69   0.15000  1.0 3.0
   59    58    67    70   0.15000  1.0 3.0
   59    58    71    72   0.15000  1.0 3.0
   59    58    71    73   0.15000  1.0 3.0
   59    58    71    74   0.15000  1.0 3.0
   67    58    71    72   0.15000  1.0 3.0
   67    58    71    73   0.15000  1.0 3.0
   67    58    71    74   0.15000  1.0 3.0
   71    58    67    68   0.15000  1.0 3.0
   71    58    67    69   0.15000  1.0 3.0
   71    58    67    70   0.15000  1.0 3.0
   50    40    48    49   0.23400  1.0 3.0
   50    40    48    55   0.86500  1.0 1.0
   50    40    48    55  -0.17500 -1.0 2.0
   50    40    48    55   0.20800  1.0 3.0
   50    40    48    58   0.86500  1.0 1.0
   50    40    48    58  -0.17500 -1.0 2.0
   50    40    48    58   0.20800  1.0 3.0
IPHI
    9     5     7     8  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
   37    30    35    36  10.50000 -1.0 2.0
   79    89    84    85  10.50000 -1.0 2.0
END
