* LIGAND DATABASE FILE (OPLS2005)
*
001     112   115    202    315     579
    1     0 S   NP   _N1_     1    28.84855    96.67605   -23.57159
    2     1 S   H    _HN1     2     1.02787   103.64787   -83.57410
    3     1 S   H    _H1_     3     1.02952    70.11773    21.29416
    4     1 S   H    _H2_     4     1.02830    40.89151   174.73605
    5     1 S   CT   _CA1     5     1.50107   141.10909   119.46493
    6     5 S   HC   _HA1     6     1.09573   105.20978    94.32621
    7     5 S   CO3  _C1_     7     1.53782   112.47039   -25.92664
    8     7 S   O2Z  _O11     8     1.26368   115.01193   -42.74072
    9     7 S   O2Z  _O12     9     1.26241   114.93778   136.44273
   10     5 S   CT   _CB1    10     1.53075   107.42223  -147.69802
   11    10 S   HC   HB11    11     1.09834   109.36077   -49.99917
   12    10 S   HC   HB12    12     1.09815   110.43455    66.58733
   13    10 S   CT   _CG1    13     1.52999   112.63562  -171.00689
   14    13 S   HC   HG11    14     1.09584   110.61138   -65.27708
   15    13 S   HC   HG12    15     1.09665   109.83055    53.98021
   16    13 S   C    _CD1    16     1.51777   112.21261   174.40953
   17    16 S   O    _OE1    17     1.22729   123.24942     5.22018
   18    16 S   N    _N2_    18     1.38627   111.68349  -174.74704
   19    18 S   H    _HN2    19     1.01579   119.01179     1.72033
   20    18 S   CT1  _CA2    20     1.46138   123.39378   178.11280
   21    20 S   HC   _HA2    21     1.09598   109.18023     4.29049
   22    20 S   C    _C2_    22     1.53525   108.65892  -111.24623
   23    22 S   O    _O2_    23     1.23070   122.44894  -144.10527
   24    20 S   CT   _CB2    32     1.53238   111.57612   126.25216
   25    24 S   HC   HB21    33     1.09479   109.72686    53.97165
   26    24 S   HC   HB22    34     1.09359   109.25241   172.79486
   27    22 S   N    _N3_    24     1.38349   113.51677    43.39057
   28    27 S   H    _HN3    25     1.01570   119.53112    -4.30120
   29    24 S   S    _SG2    35     1.83298   111.17366   -67.40027
   30    27 S   CT   _CA3    26     1.45260   123.20839   179.01127
   31    30 S   HC   HA31    27     1.09463   108.53292   -42.14115
   32    30 S   HC   HA32    28     1.09539   107.22008    74.12524
   33    29 S   CT   _C24    36     1.86087   101.76406   179.03531
   34    30 S   CO3  _C3_    29     1.52882   113.81781  -165.51789
   35    34 S   O2Z  _O31    30     1.26373   115.88669   -18.54525
   36    34 S   O2Z  _O32    31     1.26403   114.54293   161.74001
   37    33 S   CM   _C25    37     1.53853   110.54523   -60.64813
   38    33 S   CM   _C28   108     1.52124   107.83352   178.27184
   39    38 S   HC   _H23   109     1.09046   115.93616    46.67838
   40    37 S   CMA  _C26    38     1.35320   109.16201   119.28648
   41    40 S   OM   _O34    39     1.25296   136.78913   179.23230
   42    37 S   CT   _C27   104     1.49274   123.49274   -61.87091
   43    42 S   HC   _H20   105     1.09409   110.75642   -59.11629
   44    42 S   HC   _H21   106     1.09483   111.79532  -178.80074
   45    42 S   HC   _H22   107     1.09395   110.90574    61.46201
   46    38 S   CM   _C29   110     1.34042   128.02248  -135.22705
   47    46 S   HC   _H24   111     1.08519   120.07264  -179.08593
   48    46 S   HC   _H25   112     1.08343   122.71929    -0.11869
   49    40 S   NE   _N7_    40     1.37801   109.43795    -1.05925
   50    49 S   H    _H19    41     1.00750   120.96597   176.93593
   51    33 S   CM   _C23    42     1.54692   110.44043    51.41523
   52    51 S   CM   _C22    43     1.34558   125.17492    59.26498
   53    52 S   HC   _H18    44     1.08728   118.97374     4.51883
   54    52 S   C5A  _C21    45     1.41765   124.49803  -174.70539
   55    54 S   C5BC _C20    46     1.38600   132.83046  -144.54175
   56    55 S   C5BC _C19    47     1.43846   107.27499  -174.47405
   57    55 S   CT   _C30   100     1.48896   126.42585     4.13455
   58    57 S   HC   _H26   101     1.09449   110.17910  -100.55123
   59    57 S   HC   _H27   102     1.09467   111.55521    19.59969
   60    57 S   HC   _H28   103     1.09432   110.95438   139.26376
   61    56 S   C5A  _C18    48     1.38734   107.06118     0.04846
   62    56 S   CT   _C31    91     1.49924   126.25150   178.60254
   63    62 S   HC   _H29    92     1.09703   109.09927    40.62041
   64    62 S   HC   _H30    93     1.09666   109.81718   155.99515
   65    54 S   NA   _N6_    49     1.37182   119.52270    41.14693
   66    65 S   H    _H17    50     1.01124   124.80147    -2.23213
   67    61 S   CT   _C17    51     1.49733   131.77204   177.86439
   68    67 S   HC   _H15    52     1.09776   110.07862   156.49498
   69    67 S   HC   _H16    53     1.09568   109.31368    40.59033
   70    62 S   CT   _C32    94     1.52603   112.28343   -81.60251
   71    70 S   HC   _H31    95     1.09731   109.92283    58.16184
   72    70 S   HC   _H32    96     1.09689   109.82232   -58.92271
   73    67 S   C5A  _C7_    54     1.49572   111.86586   -82.20160
   74    70 S   CO3  _C33    97     1.53057   114.93471   179.26565
   75    74 S   O2Z  _O36    98     1.26531   114.06559   174.89052
   76    74 S   O2Z  _O35    99     1.26130   116.65864    -5.63326
   77    73 S   C5BC _C6_    55     1.38682   131.69862   119.81174
   78    77 S   C5BC _C5_    56     1.43831   107.07918  -177.55495
   79    77 S   CT   _C34    82     1.49951   126.65917     2.18194
   80    79 S   HC   _H33    83     1.09699   109.54563  -152.26252
   81    79 S   HC   _H34    84     1.09673   109.64999   -36.66221
   82    78 S   C5A  _C8_    57     1.38653   107.24990     0.54823
   83    78 S   CT   _C4_    78     1.48865   125.82759   179.21865
   84    83 S   HC   _H3_    79     1.09475   110.49927    51.98561
   85    83 S   HC   _H4_    80     1.09413   111.93765   171.97199
   86    83 S   HC   _H5_    81     1.09475   110.18062   -67.86282
   87    79 S   CT   _C35    85     1.52617   111.83637    85.63335
   88    87 S   HC   _H35    86     1.09778   109.67542    57.65943
   89    87 S   HC   _H36    87     1.09779   109.66453   -59.29298
   90    73 S   NA   _N4_    58     1.37266   120.93552   -61.18097
   91    90 S   H    _H6_    59     1.01110   124.41947    -1.84907
   92    82 S   CM   _C9_    60     1.41953   133.17968  -179.85463
   93    92 S   HC   _H7_    61     1.08688   115.99838    39.43412
   94    87 S   CO3  _C36    88     1.53035   115.33263   179.09908
   95    94 S   O2Z  _O38    89     1.26546   114.02271   178.05248
   96    94 S   O2Z  _O37    90     1.26085   116.71481    -2.05424
   97    92 S   CM   _C10    62     1.34234   124.64688  -138.78806
   98    97 S   CM   _C11    63     1.45532   127.65874  -178.64940
   99    98 S   CM   _C12    64     1.34876   110.42496  -179.75292
  100    98 S   CT   _C16    74     1.49397   121.63924     2.08966
  101   100 S   HC   _H12    75     1.09495   110.37129   -70.01294
  102   100 S   HC   _H13    76     1.09321   112.56794   169.43320
  103   100 S   HC   _H14    77     1.09487   110.94401    50.07591
  104    99 S   C    _C13    65     1.49307   106.22918    -0.42475
  105   104 S   O    _O33    66     1.21861   125.98077  -179.66428
  106    99 S   CM   _C14    69     1.43665   131.70383  -177.37714
  107   106 S   HC   _H9_    70     1.08730   116.06666   135.42320
  108    97 S   N    _N5_    67     1.36739   126.73054     1.83952
  109   108 S   H    _H8_    68     1.01216   124.75597     1.57495
  110   106 S   CM   _C15    71     1.33769   125.29077   -47.11202
  111   110 S   HC   _H10    72     1.08503   120.17823  -178.91357
  112   110 S   HC   _H11    73     1.08459   122.25802     0.56614
  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
  18   2   1   1  13   9   4   9   4   5   2   1   1   3   1   1
   5   2   5   8   3  11  13  18   6   2   1   1  12  10   5   4
   5   1   9   4   3   5   4   3  11   2   1   1  16  14  11   5
   4  11   5   2   1   1   5   4   3   4   1   8   3   2   1   1
  11  12  13   6   2   1   1   6   3   5   3   1   1   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    51    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    49    51    52    42    38    39    46  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    41    49    50    51    52    53    54    42    43    44    45    38    39    46    47    48  
   35    36  
   36  
    0  
   40    41    49    50    51    52    42    43    44    45    38    39    46  
   39    46    47    48    40    42    49    51    52  
   46    47    48    51  
   41    49    50    51    52    42    43    44    45  
   49    50    51    42  
   43    44    45    49    51  
   44    45  
   45  
    0  
   47    48    51  
   48  
    0  
   50    51    52    53    54  
   51    52  
   52    53    54    55    65  
   53    54    55    56    61    65    66    57  
   54    55    65  
   55    56    61    65    66    67    62    57    58    59    60  
   56    61    65    66    67    62    63    64    70    57    58    59    60  
   61    65    66    67    68    69    73    62    63    64    70    71    72    74    57    58    59    60  
   58    59    60    61    62    65  
   59    60  
   60  
    0  
   65    66    67    68    69    73    77    90    62    63    64    70  
   63    64    70    71    72    74    75    76    65    67  
   64    70    71    72    74  
   70    71    72    74  
   66    67    68    69    73  
   67  
   68    69    73    77    78    82    90    91    79  
   69    73    77    90  
   73    77    90  
   71    72    74    75    76  
   72    74    75    76  
   74    75    76  
   77    78    82    90    91    92    83    79    80    81    87  
   75    76  
   76  
    0  
   78    82    90    91    92    83    84    85    86    79    80    81    87    88    89    94  
   82    90    91    92    93    97    83    84    85    86    79    80    81    87  
   80    81    87    88    89    94    95    96    82    83    90  
   81    87    88    89    94  
   87    88    89    94  
   90    91    92    93    97    98   108    83    84    85    86  
   84    85    86    90    92  
   85    86  
   86  
    0  
   88    89    94    95    96  
   89    94    95    96  
   94    95    96  
   91    92    93    97  
   92  
   93    97    98    99   104   108   109   100  
   97    98   108  
   95    96  
   96  
    0  
   98    99   104   105   108   109   106   100   101   102   103  
   99   104   105   108   109   106   107   110   100   101   102   103  
  104   105   108   109   106   107   110   111   112   100   101   102   103  
  101   102   103   104   106   108  
  102   103  
  103  
    0  
  105   108   109   106   107   110  
  108   109   106  
  107   110   111   112   108  
  110   111   112  
  109  
    0  
  111   112  
  112  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760   0.497600   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   47   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   48   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   49   3.2500   0.1700  -0.894200   1.8650   1.6500   0.051222218  -2.220205820
   50   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   51   3.5500   0.0760   0.018000   2.0020   1.7750   0.023028004  -0.852763146
   52   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   53   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0700  -0.008000   2.0020   1.7750   0.001000000  -0.843144165
   55   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   56   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   57   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5500   0.0700  -0.163000   2.0020   1.7750   0.001000000  -0.843144165
   62   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.2500   0.1700  -0.239000   1.8650   1.6500   0.001000000  -0.511443539
   66   0.5000   0.0300   0.317000   0.9960   0.8600   0.030040813  -0.651083722
   67   3.5000   0.0660   0.190000   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   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   73   3.5500   0.0700  -0.163000   2.0020   1.7750   0.001000000  -0.843144165
   74   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   75   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   76   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   77   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   78   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   79   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   3.5500   0.0700  -0.008000   2.0020   1.7750   0.001000000  -0.843144165
   83   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   88   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   89   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   90   3.2500   0.1700  -0.239000   1.8650   1.6500   0.001000000  -0.511443539
   91   0.5000   0.0300   0.317000   0.9960   0.8600   0.030040813  -0.651083722
   92   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   93   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   94   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   95   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   96   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   97   3.5500   0.0760   0.051300   2.0020   1.7750   0.023028004  -0.852763146
   98   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   99   3.5500   0.0760  -0.056700   2.0020   1.7750   0.023028004  -0.852763146
  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   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
  105   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
  106   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
  107   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  108   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
  109   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
  110   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
  111   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  112   2.4200   0.0300   0.115000   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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    51   317.000  1.510
   33    38   317.000  1.510
   37    40   465.000  1.376
   37    42   317.000  1.510
   40    41   745.000  1.250
   40    49   415.000  1.382
   49    50   434.000  1.010
   49    51   425.000  1.378
   51    52   549.000  1.340
   52    53   340.000  1.080
   52    54   375.000  1.423
   54    55   546.000  1.367
   54    65   427.000  1.381
   55    56   469.000  1.424
   55    57   285.000  1.502
   56    61   546.000  1.367
   56    62   285.000  1.502
   61    65   427.000  1.381
   61    67   295.000  1.489
   65    66   434.000  1.010
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    73   295.000  1.489
   73    77   546.000  1.367
   73    90   427.000  1.381
   77    78   469.000  1.424
   77    79   285.000  1.502
   78    82   546.000  1.367
   78    83   285.000  1.502
   82    90   427.000  1.381
   82    92   375.000  1.423
   90    91   434.000  1.010
   92    93   340.000  1.080
   92    97   549.000  1.340
   97    98   380.000  1.444
   97   108   400.000  1.384
   98    99   549.000  1.340
   98   100   317.000  1.510
   99   104   410.000  1.444
   99   106   380.000  1.444
  104   105   570.000  1.229
  104   108   490.000  1.335
  108   109   434.000  1.010
  106   107   340.000  1.080
  106   110   549.000  1.340
  110   111   340.000  1.080
  110   112   340.000  1.080
  100   101   340.000  1.090
  100   102   340.000  1.090
  100   103   340.000  1.090
   83    84   340.000  1.090
   83    85   340.000  1.090
   83    86   340.000  1.090
   79    80   340.000  1.090
   79    81   340.000  1.090
   79    87   268.000  1.529
   87    88   340.000  1.090
   87    89   340.000  1.090
   87    94   317.000  1.522
   94    95   656.000  1.250
   94    96   656.000  1.250
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    70   268.000  1.529
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    74   317.000  1.522
   74    75   656.000  1.250
   74    76   656.000  1.250
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   340.000  1.090
   38    39   340.000  1.080
   38    46   549.000  1.340
   46    47   340.000  1.080
   46    48   340.000  1.080
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    51    75.00000  112.20000
   29    33    38    75.00000  112.20000
   33    37    40    70.00000  124.00000
   33    37    42    65.00000  117.92700
   33    51    49    75.00000  116.24600
   33    51    52    70.00000  124.00000
   33    38    39    35.00000  117.00000
   33    38    46    70.00000  124.00000
   37    40    41    65.00000  137.10300
   37    40    49    75.00000  114.40000
   37    42    43    35.00000  109.50000
   37    42    44    35.00000  109.50000
   37    42    45    35.00000  109.50000
   40    49    50    50.00000  121.48000
   40    49    51    75.00000  118.45600
   49    40    41   105.00000  113.92000
   49    51    52    70.00000  124.03900
   51    33    37    70.00000  110.12100
   51    49    50    35.00000  114.50000
   51    52    53    35.00000  120.00000
   51    52    54    55.00000  128.24000
   52    54    55    50.00000  133.16000
   52    54    65    70.00000  120.38000
   54    52    53    40.00000  117.26300
   54    55    56    70.00000  107.30000
   54    55    57    60.00000  130.00000
   54    65    61    70.00000  109.80000
   54    65    66    35.00000  120.00000
   55    56    61    70.00000  107.30000
   55    56    62    60.00000  130.00000
   55    57    58    35.00000  109.50000
   55    57    59    35.00000  109.50000
   55    57    60    35.00000  109.50000
   56    61    65    70.00000  107.70000
   56    61    67    50.00000  133.50000
   56    62    63    35.00000  109.50000
   56    62    64    35.00000  109.50000
   56    62    70    70.00000  112.17500
   61    65    66    35.00000  120.00000
   61    67    68    45.00000  110.47400
   61    67    69    45.00000  110.47400
   61    67    73    70.00000  112.04700
   65    54    55    70.00000  107.70000
   67    61    65    65.00000  122.56900
   67    73    77    50.00000  133.50000
   67    73    90    65.00000  122.56900
   69    67    68    33.00000  107.80000
   73    67    68    45.00000  110.47400
   73    67    69    45.00000  110.47400
   73    77    78    70.00000  107.30000
   73    77    79    60.00000  130.00000
   73    90    82    70.00000  109.80000
   73    90    91    35.00000  120.00000
   77    78    82    70.00000  107.30000
   77    78    83    60.00000  130.00000
   77    79    80    35.00000  109.50000
   77    79    81    35.00000  109.50000
   77    79    87    70.00000  112.17500
   78    82    90    70.00000  107.70000
   78    82    92    50.00000  133.16000
   78    83    84    35.00000  109.50000
   78    83    85    35.00000  109.50000
   78    83    86    35.00000  109.50000
   82    90    91    35.00000  120.00000
   82    92    93    40.00000  117.26300
   82    92    97    55.00000  128.24000
   90    73    77    70.00000  107.70000
   92    82    90    70.00000  120.38000
   92    97    98    70.00000  123.01800
   92    97   108    75.00000  120.83300
   97    92    93    35.00000  120.00000
   97    98    99    70.00000  123.01800
   97    98   100    70.00000  124.00000
   97   108   104    70.00000  120.89900
   97   108   109    45.00000  117.55000
   98    99   104    70.00000  118.70000
   98    99   106    70.00000  123.01800
   98   100   101    35.00000  109.50000
   98   100   102    35.00000  109.50000
   98   100   103    35.00000  109.50000
   99   104   105    80.00000  125.30000
   99   104   108    80.00000  111.56200
   99   106   107    35.00000  120.00000
   99   106   110    70.00000  123.01800
  104   108   109    35.00000  119.80000
  108    97    98    75.00000  120.83300
  108   104   105    80.00000  122.90000
  106    99   104    70.00000  118.70000
  106   110   111    35.00000  120.00000
  106   110   112    35.00000  120.00000
  110   106   107    35.00000  120.00000
  112   110   111    35.00000  117.00000
  100    98    99    70.00000  124.00000
  102   100   101    33.00000  107.80000
  103   100   101    33.00000  107.80000
  103   100   102    33.00000  107.80000
   83    78    82    60.00000  130.00000
   85    83    84    33.00000  107.80000
   86    83    84    33.00000  107.80000
   86    83    85    33.00000  107.80000
   79    77    78    60.00000  130.00000
   79    87    88    37.50000  110.70000
   79    87    89    37.50000  110.70000
   79    87    94    70.00000  109.69300
   81    79    80    33.00000  107.80000
   87    79    80    37.50000  110.70000
   87    79    81    37.50000  110.70000
   87    94    95    70.00000  117.00000
   87    94    96    70.00000  117.00000
   89    87    88    33.00000  107.80000
   94    87    88    35.00000  109.50000
   94    87    89    35.00000  109.50000
   96    94    95    80.00000  126.00000
   62    56    61    60.00000  130.00000
   62    70    71    37.50000  110.70000
   62    70    72    37.50000  110.70000
   62    70    74    70.00000  109.69300
   64    62    63    33.00000  107.80000
   70    62    63    37.50000  110.70000
   70    62    64    37.50000  110.70000
   70    74    75    70.00000  117.00000
   70    74    76    70.00000  117.00000
   72    70    71    33.00000  107.80000
   74    70    71    35.00000  109.50000
   74    70    72    35.00000  109.50000
   76    74    75    80.00000  126.00000
   57    55    56    60.00000  130.00000
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
   42    37    40    70.00000  124.00000
   44    42    43    33.00000  107.80000
   45    42    43    33.00000  107.80000
   45    42    44    33.00000  107.80000
   38    33    37    70.00000  110.12100
   38    33    51    70.00000  110.12100
   38    46    47    35.00000  120.00000
   38    46    48    35.00000  120.00000
   46    38    39    35.00000  120.00000
   48    46    47    35.00000  117.00000
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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -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    34    35   0.00000  1.0 1.0
   27    30    34    36   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    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   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    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    51  -0.62250  1.0 1.0
   24    29    33    51  -0.38450 -1.0 2.0
   24    29    33    51   0.81900  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  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    37    40   0.42700  1.0 1.0
   29    33    37    40  -0.70350 -1.0 2.0
   29    33    37    40  -0.43150  1.0 3.0
   29    33    37    42   0.30250  1.0 1.0
   29    33    37    42  -0.14950 -1.0 2.0
   29    33    37    42   0.36900  1.0 3.0
   29    33    51    49   0.09700  1.0 1.0
   29    33    51    49   0.15600 -1.0 2.0
   29    33    51    49  -0.50800  1.0 3.0
   29    33    51    52   0.42700  1.0 1.0
   29    33    51    52  -0.70350 -1.0 2.0
   29    33    51    52  -0.43150  1.0 3.0
   29    33    38    39   0.00000  1.0 1.0
   29    33    38    46   0.42700  1.0 1.0
   29    33    38    46  -0.70350 -1.0 2.0
   29    33    38    46  -0.43150  1.0 3.0
   33    37    40    41   7.00000 -1.0 2.0
   33    37   -40    49   7.00000 -1.0 2.0
   33    37    42    43   0.34800  1.0 3.0
   33    37    42    44   0.34800  1.0 3.0
   33    37    42    45   0.34800  1.0 3.0
   33    51    52    53   7.00000 -1.0 2.0
   33    51    52    54   7.00000 -1.0 2.0
   33    38    46    47   7.00000 -1.0 2.0
   33    38    46    48   7.00000 -1.0 2.0
   37    33   -51    49  -1.35150  1.0 1.0
   37    33   -51    49   0.13900 -1.0 2.0
   37    33   -51    49   0.25250  1.0 3.0
   37    33    51    52  -0.28300  1.0 1.0
   37    33    51    52   0.26700 -1.0 2.0
   37    33    51    52  -0.63300  1.0 3.0
   37    33    38    39   0.00000  1.0 1.0
   37    33    38    46  -0.28300  1.0 1.0
   37    33    38    46   0.26700 -1.0 2.0
   37    33    38    46  -0.63300  1.0 3.0
   37    40    49    50   1.00000 -1.0 2.0
   37    40   -49    51  -0.54500  1.0 1.0
   37    40   -49    51   1.14150 -1.0 2.0
   40    37    42    43   0.00000  1.0 1.0
   40    37    42    44   0.00000  1.0 1.0
   40    37    42    45   0.00000  1.0 1.0
   40    49   -51    33   1.00000 -1.0 2.0
   40    49    51    52  -0.54500  1.0 1.0
   40    49    51    52   1.14150 -1.0 2.0
   41    40    49    50   1.00000 -1.0 2.0
   41    40    49    51   1.00000 -1.0 2.0
   49    51    52    53   7.00000 -1.0 2.0
   49    51    52    54   7.00000 -1.0 2.0
   50    49    51    33   2.40850 -1.0 2.0
   50    49    51    52   1.00000 -1.0 2.0
   51    33   -37    40  -0.28300  1.0 1.0
   51    33   -37    40   0.26700 -1.0 2.0
   51    33   -37    40  -0.63300  1.0 3.0
   51    33    37    42   0.09700  1.0 1.0
   51    33    37    42   0.15600 -1.0 2.0
   51    33    37    42  -0.50800  1.0 3.0
   51    33    38    39   0.00000  1.0 1.0
   51    33    38    46  -0.28300  1.0 1.0
   51    33    38    46   0.26700 -1.0 2.0
   51    33    38    46  -0.63300  1.0 3.0
   51    52    54    55   0.15800  1.0 1.0
   51    52    54    55   1.85350 -1.0 2.0
   51    52    54    55  -0.48700  1.0 3.0
   51    52    54    65   0.11450  1.0 1.0
   51    52    54    65   1.85100 -1.0 2.0
   51    52    54    65  -0.49050  1.0 3.0
   52    54    55    56   3.62500 -1.0 2.0
   52    54    55    57   3.62500 -1.0 2.0
   52    54    65    61   3.62500 -1.0 2.0
   52    54    65    66   2.00000 -1.0 2.0
   53    52    54    55   0.56550  1.0 3.0
   53    52    54    65   0.54250  1.0 3.0
   54    55   -56    61   3.62500 -1.0 2.0
   54    55    56    62   3.62500 -1.0 2.0
   54    55    57    58   0.00000  1.0 1.0
   54    55    57    59   0.00000  1.0 1.0
   54    55    57    60   0.00000  1.0 1.0
   55    54   -65    61   3.62500 -1.0 2.0
   55    54    65    66   2.00000 -1.0 2.0
   55    56   -61    65   3.62500 -1.0 2.0
   55    56    61    67   3.62500 -1.0 2.0
   55    56    62    63   0.00000  1.0 1.0
   55    56    62    64   0.00000  1.0 1.0
   55    56    62    70   0.04150 -1.0 2.0
   56    55    57    58   0.00000  1.0 1.0
   56    55    57    59   0.00000  1.0 1.0
   56    55    57    60   0.00000  1.0 1.0
   56    61   -65    54   3.62500 -1.0 2.0
   56    61    65    66   2.00000 -1.0 2.0
   56    61    67    68   0.00000  1.0 1.0
   56    61    67    69   0.00000  1.0 1.0
   56    61    67    73   0.04300 -1.0 2.0
   56    62    70    71   0.43200  1.0 3.0
   56    62    70    72   0.43200  1.0 3.0
   56    62    70    74  -2.95950  1.0 1.0
   56    62    70    74   0.02300  1.0 3.0
   61    56    62    63   0.00000  1.0 1.0
   61    56    62    64   0.00000  1.0 1.0
   61    56    62    70   0.04150 -1.0 2.0
   61    67    73    77   0.04300 -1.0 2.0
   61    67    73    90   0.04300 -1.0 2.0
   65    54   -55    56   3.62500 -1.0 2.0
   65    54    55    57   3.62500 -1.0 2.0
   65    61    67    68   0.00000  1.0 1.0
   65    61    67    69   0.00000  1.0 1.0
   65    61    67    73   0.04300 -1.0 2.0
   67    61    65    54   3.62500 -1.0 2.0
   67    61    65    66   2.00000 -1.0 2.0
   67    73    77    78   3.62500 -1.0 2.0
   67    73    77    79   3.62500 -1.0 2.0
   67    73    90    82   3.62500 -1.0 2.0
   67    73    90    91   2.00000 -1.0 2.0
   68    67    73    77   0.00000  1.0 1.0
   68    67    73    90   0.00000  1.0 1.0
   69    67    73    77   0.00000  1.0 1.0
   69    67    73    90   0.00000  1.0 1.0
   73    77   -78    82   3.62500 -1.0 2.0
   73    77    78    83   3.62500 -1.0 2.0
   73    77    79    80   0.00000  1.0 1.0
   73    77    79    81   0.00000  1.0 1.0
   73    77    79    87   0.04150 -1.0 2.0
   77    73   -90    82   3.62500 -1.0 2.0
   77    73    90    91   2.00000 -1.0 2.0
   77    78   -82    90   3.62500 -1.0 2.0
   77    78    82    92   3.62500 -1.0 2.0
   77    78    83    84   0.00000  1.0 1.0
   77    78    83    85   0.00000  1.0 1.0
   77    78    83    86   0.00000  1.0 1.0
   77    79    87    88   0.43200  1.0 3.0
   77    79    87    89   0.43200  1.0 3.0
   77    79    87    94  -2.95950  1.0 1.0
   77    79    87    94   0.02300  1.0 3.0
   78    77    79    80   0.00000  1.0 1.0
   78    77    79    81   0.00000  1.0 1.0
   78    77    79    87   0.04150 -1.0 2.0
   78    82   -90    73   3.62500 -1.0 2.0
   78    82    90    91   2.00000 -1.0 2.0
   78    82    92    93   0.56550  1.0 3.0
   78    82    92    97   0.15800  1.0 1.0
   78    82    92    97   1.85350 -1.0 2.0
   78    82    92    97  -0.48700  1.0 3.0
   82    78    83    84   0.00000  1.0 1.0
   82    78    83    85   0.00000  1.0 1.0
   82    78    83    86   0.00000  1.0 1.0
   82    92    97    98   7.00000 -1.0 2.0
   82    92    97   108   7.00000 -1.0 2.0
   90    73   -77    78   3.62500 -1.0 2.0
   90    73    77    79   3.62500 -1.0 2.0
   90    82    92    93   0.54250  1.0 3.0
   90    82    92    97   0.11450  1.0 1.0
   90    82    92    97   1.85100 -1.0 2.0
   90    82    92    97  -0.49050  1.0 3.0
   92    82    90    73   3.62500 -1.0 2.0
   92    82    90    91   2.00000 -1.0 2.0
   92    97    98    99   0.28850  1.0 1.0
   92    97    98    99   2.61350 -1.0 2.0
   92    97    98    99   0.78400  1.0 3.0
   92    97    98   100  -0.18600  1.0 3.0
   92    97   108   104  -0.18900  1.0 1.0
   92    97   108   104   1.70900 -1.0 2.0
   92    97   108   109   0.78350 -1.0 2.0
   93    92    97    98   7.00000 -1.0 2.0
   93    92    97   108   7.00000 -1.0 2.0
   97    98   -99   104   7.00000 -1.0 2.0
   97    98    99   106   7.00000 -1.0 2.0
   97    98   100   101   0.00000  1.0 1.0
   97    98   100   102   0.00000  1.0 1.0
   97    98   100   103   0.00000  1.0 1.0
   98    97  -108   104  -0.18900  1.0 1.0
   98    97  -108   104   1.70900 -1.0 2.0
   98    97   108   109   0.78350 -1.0 2.0
   98    99   104   105   1.00000 -1.0 2.0
   98    99  -104   108   0.49500  1.0 1.0
   98    99  -104   108   1.31600 -1.0 2.0
   98    99  -104   108  -0.02300  1.0 3.0
   98    99   106   107  -0.18600  1.0 3.0
   98    99   106   110   0.28850  1.0 1.0
   98    99   106   110   2.61350 -1.0 2.0
   98    99   106   110   0.78400  1.0 3.0
   99    98   100   101   0.00000  1.0 1.0
   99    98   100   102   0.00000  1.0 1.0
   99    98   100   103   0.00000  1.0 1.0
   99   104  -108    97   2.45000 -1.0 2.0
   99   104   108   109   2.56700 -1.0 2.0
   99   106   110   111   7.00000 -1.0 2.0
   99   106   110   112   7.00000 -1.0 2.0
  104    99   106   107   0.00000  1.0 1.0
  104    99   106   110  -0.18600  1.0 3.0
  105   104   108    97   2.67200 -1.0 2.0
  105   104   108   109   2.45000 -1.0 2.0
  108    97   -98    99  -0.18600  1.0 3.0
  108    97    98   100   1.08500 -1.0 2.0
  106    99   104   105   1.00000 -1.0 2.0
  106    99   104   108   0.49500  1.0 1.0
  106    99   104   108   1.31600 -1.0 2.0
  106    99   104   108  -0.02300  1.0 3.0
  107   106   110   111   7.00000 -1.0 2.0
  107   106   110   112   7.00000 -1.0 2.0
  100    98    99   104   7.00000 -1.0 2.0
  100    98    99   106   7.00000 -1.0 2.0
   83    78    82    90   3.62500 -1.0 2.0
   83    78    82    92   3.62500 -1.0 2.0
   79    77    78    82   3.62500 -1.0 2.0
   79    77    78    83   3.62500 -1.0 2.0
   79    87    94    95   0.41150 -1.0 2.0
   79    87    94    96   0.41150 -1.0 2.0
   80    79    87    88   0.15000  1.0 3.0
   80    79    87    89   0.15000  1.0 3.0
   80    79    87    94  -0.11250  1.0 3.0
   81    79    87    88   0.15000  1.0 3.0
   81    79    87    89   0.15000  1.0 3.0
   81    79    87    94  -0.11250  1.0 3.0
   88    87    94    95   0.00000  1.0 1.0
   88    87    94    96   0.00000  1.0 1.0
   89    87    94    95   0.00000  1.0 1.0
   89    87    94    96   0.00000  1.0 1.0
   62    56    61    65   3.62500 -1.0 2.0
   62    56    61    67   3.62500 -1.0 2.0
   62    70    74    75   0.41150 -1.0 2.0
   62    70    74    76   0.41150 -1.0 2.0
   63    62    70    71   0.15000  1.0 3.0
   63    62    70    72   0.15000  1.0 3.0
   63    62    70    74  -0.11250  1.0 3.0
   64    62    70    71   0.15000  1.0 3.0
   64    62    70    72   0.15000  1.0 3.0
   64    62    70    74  -0.11250  1.0 3.0
   71    70    74    75   0.00000  1.0 1.0
   71    70    74    76   0.00000  1.0 1.0
   72    70    74    75   0.00000  1.0 1.0
   72    70    74    76   0.00000  1.0 1.0
   57    55    56    61   3.62500 -1.0 2.0
   57    55    56    62   3.62500 -1.0 2.0
   42    37    40    41   7.00000 -1.0 2.0
   42    37    40    49   7.00000 -1.0 2.0
   38    33    37    40  -0.28300  1.0 1.0
   38    33    37    40   0.26700 -1.0 2.0
   38    33    37    40  -0.63300  1.0 3.0
   38    33    37    42   0.09700  1.0 1.0
   38    33    37    42   0.15600 -1.0 2.0
   38    33    37    42  -0.50800  1.0 3.0
   38    33    51    49  -1.35150  1.0 1.0
   38    33    51    49   0.13900 -1.0 2.0
   38    33    51    49   0.25250  1.0 3.0
   38    33    51    52  -0.28300  1.0 1.0
   38    33    51    52   0.26700 -1.0 2.0
   38    33    51    52  -0.63300  1.0 3.0
   39    38    46    47   7.00000 -1.0 2.0
   39    38    46    48   7.00000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    42    37    40   1.10000 -1.0 2.0
   49    41    40    37   1.10000 -1.0 2.0
   50    40    49    51   1.00000 -1.0 2.0
   33    49    51    52   1.10000 -1.0 2.0
   54    53    52    51   1.10000 -1.0 2.0
   55    65    54    52   4.00000 -1.0 2.0
   56    57    55    54   4.00000 -1.0 2.0
   61    62    56    55   4.00000 -1.0 2.0
   67    65    61    56   4.00000 -1.0 2.0
   66    54    65    61   1.00000 -1.0 2.0
   77    90    73    67   4.00000 -1.0 2.0
   78    79    77    73   4.00000 -1.0 2.0
   82    83    78    77   4.00000 -1.0 2.0
   92    90    82    78   4.00000 -1.0 2.0
   91    73    90    82   1.00000 -1.0 2.0
   82    93    92    97   1.10000 -1.0 2.0
   98   108    97    92   1.10000 -1.0 2.0
   97   100    98    99   1.10000 -1.0 2.0
  104   106    99    98   1.10000 -1.0 2.0
   99   108   104   105  10.50000 -1.0 2.0
  109   104   108    97   1.00000 -1.0 2.0
   99   107   106   110  15.00000 -1.0 2.0
  111   112   110   106  15.00000 -1.0 2.0
   95    87    94    96  10.50000 -1.0 2.0
   75    70    74    76  10.50000 -1.0 2.0
   33    39    38    46  15.00000 -1.0 2.0
   47    48    46    38  15.00000 -1.0 2.0
END
