* LIGAND DATABASE FILE (OPLS2005)
*
001     103   105    195    283     562
    1     0 S   NP   _N1_     1    30.01339    95.40914   -15.05862
    2     1 S   H    _HN1     2     1.02735    52.62009   135.41560
    3     1 S   H    _H1_     3     1.04154    58.56371   -13.99117
    4     1 S   H    _H2_     4     1.03424   139.42028    64.92297
    5     1 S   CT   _CA1     5     1.49653   107.01086  -120.50479
    6     5 S   HC   _HA1     6     1.09679   104.67389     9.83191
    7     5 S   CO3  _C1_     7     1.54651   111.67911  -106.23173
    8     7 S   O2Z  _O11     8     1.26254   116.79460  -121.96738
    9     7 S   O2Z  _O12     9     1.26631   114.09461    58.17418
   10     5 S   CT   _CB1    10     1.53155   107.77486   126.41509
   11    10 S   HC   HB11    11     1.09680   110.64940   -39.94723
   12    10 S   HC   HB12    12     1.09736   109.98937    76.44505
   13    10 S   CT   _CG1    13     1.53199   111.87837  -159.98783
   14    13 S   HC   HG11    14     1.09555   111.89859   -42.45374
   15    13 S   HC   HG12    15     1.09619   110.20421    75.97230
   16    13 S   C    _CD1    16     1.51352   110.91188  -163.71362
   17    16 S   O    _OE1    17     1.22785   121.99390   -98.14101
   18    16 S   N    _N2_    18     1.38539   112.54755    81.21699
   19    18 S   H    _HN2    19     1.01699   118.76624     1.70514
   20    18 S   CT1  _CA2    20     1.46277   123.50686  -177.90809
   21    20 S   HC   _HA2    21     1.09733   109.36065    -3.88897
   22    20 S   C    _C2_    22     1.53367   108.68760  -119.76526
   23    22 S   O    _O2_    23     1.23045   122.15695  -145.28323
   24    20 S   CT   _CB2    32     1.53445   111.25897   117.89803
   25    24 S   HC   HB21    33     1.09593   109.51988    58.07456
   26    24 S   HC   HB22    34     1.09499   110.80944   177.14885
   27    22 S   N    _N3_    24     1.38486   113.53379    42.13039
   28    27 S   H    _HN3    25     1.01514   118.96953    -0.70776
   29    24 S   S    _SG2    35     1.82405   111.16638   -62.64957
   30    27 S   CT   _CA3    26     1.45433   123.27475   175.31801
   31    30 S   HC   HA31    27     1.09538   109.01441    28.59091
   32    30 S   HC   HA32    28     1.09492   107.17439   145.52094
   33    29 S   CT   _C18    36     1.82089    99.55829   164.21969
   34    33 S   HC   _H12    37     1.09709   108.78547   -36.86391
   35    30 S   CO3  _C3_    29     1.52933   113.28017   -94.75674
   36    35 S   O2Z  _O31    30     1.26391   115.47031   -44.36959
   37    35 S   O2Z  _O32    31     1.26373   114.96115   136.61628
   38    33 S   CT   _C19    38     1.51918   115.83336    86.50624
   39    38 S   HC   _H13    39     1.09436   113.43263   -77.65069
   40    38 S   CT   _C20    40     1.52900   101.79849   159.70561
   41    40 S   HC   _H14    41     1.09539   112.02086  -145.78882
   42    38 S   OH   _O48   102     1.42737   110.95845    44.37253
   43    42 S   HO   _H31   103     0.97223   107.62370   175.78564
   44    40 S   OS   _O47    42     1.44335   106.76504   -28.22004
   45    40 S   CT   _C21    98     1.52295   112.93331    90.01407
   46    45 S   HC   _H28    99     1.09508   111.65605   -59.68163
   47    45 S   HC   _H29   100     1.09545   110.15734  -177.70049
   48    45 S   HC   _H30   101     1.09405   111.13087    61.95510
   49    33 S   CT   _C17    43     1.52701   112.21678  -157.09016
   50    49 S   HC   _H11    44     1.09554   112.47478   -44.35150
   51    49 S   CT   _C16    45     1.52311   112.55270    81.45170
   52    51 S   HC   _H26    46     1.09547   110.63834    71.38619
   53    51 S   HC   _H27    47     1.09414   110.77424   -49.73710
   54    51 S   OS   _O46    48     1.42531   110.06288  -168.90586
   55    54 S   P2   _P3_    49     1.63668   115.93182  -177.19914
   56    55 S   O2Z  _O45    50     1.51305   108.42853    74.76606
   57    55 S   O2Z  _O44    51     1.51306   108.41882   -57.63477
   58    55 S   OS   _O43    52     1.63230    99.50882  -170.42698
   59    58 S   CT   _C12    53     1.42177   120.15645   -75.46398
   60    59 S   HC   _H8_    54     1.09493   110.13398    38.96341
   61    59 S   CT   _C13    55     1.51908   109.72901   -87.52500
   62    61 S   HC   _H9_    56     1.09283   114.67191    40.55448
   63    61 S   CT   _C14    57     1.52985   103.61411   -82.34638
   64    63 S   HC   _H10    58     1.09567   111.59309  -139.27629
   65    61 S   OH   _O42    96     1.42831   108.51781   161.48286
   66    65 S   HO   _H25    97     0.97238   107.26866   179.84805
   67    63 S   OS   _O41    59     1.44007   107.02912   -21.79775
   68    63 S   CT   _C15    92     1.52237   113.27712    96.87063
   69    68 S   HC   _H22    93     1.09462   111.77501   -60.61453
   70    68 S   HC   _H23    94     1.09551   110.12600  -178.58958
   71    68 S   HC   _H24    95     1.09406   111.15730    61.13459
   72    59 S   CT   _C11    60     1.52945   110.51397   162.20188
   73    72 S   HC   _H7_    61     1.09833   108.75004  -165.48788
   74    72 S   CT   _C10    62     1.52047   116.35701   -42.07197
   75    74 S   HC   _H20    63     1.09536   109.09215   173.25674
   76    74 S   HC   _H21    64     1.09347   111.74887    55.54622
   77    74 S   OS   _O40    65     1.41882   109.30826   -66.23041
   78    77 S   P2   _P2_    66     1.63415   119.39750  -161.26125
   79    78 S   O2Z  _O39    67     1.51337   109.38869    42.67392
   80    78 S   O2Z  _O38    68     1.51312   107.94751   174.89485
   81    78 S   OS   _O37    69     1.63567    99.89942   -70.70222
   82    81 S   CT   _C7_    70     1.42338   119.35991   -73.20850
   83    82 S   HC   _H5_    71     1.09423   109.73538    36.85744
   84    82 S   CT   _C6_    72     1.51806   109.70385   -89.18322
   85    84 S   HC   _H4_    73     1.09301   114.55439    38.90706
   86    84 S   CT   _C5_    74     1.52715   103.69635   -84.04246
   87    86 S   HC   _H3_    75     1.09565   111.67175  -139.43577
   88    84 S   OH   _O49    90     1.42551   108.58098   159.79329
   89    88 S   HO   _H32    91     0.97201   107.67476   179.45679
   90    86 S   OS   _O33    76     1.43793   107.05557   -21.87168
   91    86 S   CT   _C4_    86     1.52229   113.21012    96.73942
   92    91 S   HC   _H15    87     1.09464   111.72850   -60.47099
   93    91 S   HC   _H16    88     1.09551   110.13716  -178.44833
   94    91 S   HC   _H17    89     1.09406   111.16545    61.25929
   95    82 S   CT   _C8_    77     1.52740   110.97466   159.44779
   96    95 S   HC   _H6_    78     1.09784   110.10677  -163.64958
   97    95 S   CT   _C9_    79     1.52557   115.61038   -38.24150
   98    97 S   HC   _H18    80     1.09773   110.02585    67.64652
   99    97 S   HC   _H19    81     1.09540   109.98050   -53.63409
  100    97 S   OS   _O34    82     1.42901   107.67154  -171.99038
  101   100 S   PR   _P1_    83     1.62006   117.58940  -162.37305
  102   101 S   OM   _O36    84     1.64196    97.12666  -172.05574
  103   101 S   OM   _O35    85     1.64069    98.30624   -73.97408
  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
  15   8   2   1   1  13   7  11   7   4   1  10   4   2   1   1
   6   4   7   3   2   5   7   3   2  10  15   8  13   7  11   7
   4   1  10   4   2   1   1   6   4   7   3   2   5   7   3   2
  10  15   8  13   7  11   7   4   1  10   4   2   1   1   6   4
   6   3   2   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    49    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    44    49    50    51    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    44    49    50    51    52    53    54    45    42    43  
   38    39    40    44    49    50    51    42  
   36    37  
   37  
    0  
   39    40    41    44    49    50    51    45    46    47    48    42    43  
   40    41    44    49    45    42    43  
   41    44    49    50    51    45    46    47    48    42    43  
   44    49    45    46    47    48    42  
   43    44    45    49  
    0  
   49    50    51    52    53    54    45    46    47    48  
   46    47    48    49  
   47    48  
   48  
    0  
   50    51    52    53    54    55  
   51    52    53    54  
   52    53    54    55    56    57    58  
   53    54    55  
   54    55  
   55    56    57    58    59  
   56    57    58    59    60    61    72  
   57    58    59  
   58    59  
   59    60    61    62    63    67    72    73    74    65  
   60    61    62    63    64    67    72    73    74    75    76    77    68    65    66  
   61    62    63    67    72    73    74    65  
   62    63    64    67    72    73    74    68    69    70    71    65    66  
   63    64    67    72    68    65    66  
   64    67    72    73    74    68    69    70    71    65    66  
   67    72    68    69    70    71    65  
   66    67    68    72  
    0  
   72    73    74    75    76    77    68    69    70    71  
   69    70    71    72  
   70    71  
   71  
    0  
   73    74    75    76    77    78  
   74    75    76    77  
   75    76    77    78    79    80    81  
   76    77    78  
   77    78  
   78    79    80    81    82  
   79    80    81    82    83    84    95  
   80    81    82  
   81    82  
   82    83    84    85    86    90    95    96    97    88  
   83    84    85    86    87    90    95    96    97    98    99   100    91    88    89  
   84    85    86    90    95    96    97    88  
   85    86    87    90    95    96    97    91    92    93    94    88    89  
   86    87    90    95    91    88    89  
   87    90    95    96    97    91    92    93    94    88    89  
   90    95    91    92    93    94    88  
   89    90    91    95  
    0  
   95    96    97    98    99   100    91    92    93    94  
   92    93    94    95  
   93    94  
   94  
    0  
   96    97    98    99   100   101  
   97    98    99   100  
   98    99   100   101   102   103  
   99   100   101  
  100   101  
  101   102   103  
  102   103  
  103  
    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   0.205000   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   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   42   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   43   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   44   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   45   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660   0.080000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.8500   0.1400  -0.610000   1.7660   1.5600   0.020110767  -0.896042159
   55   3.7400   0.2000   1.760000   2.1070   1.8700   0.005000000   0.000000000
   56   2.9800   0.2000  -0.970000   1.6890   1.4900   0.001000000  -0.126889456
   57   2.9800   0.2000  -0.970000   1.6890   1.4900   0.001000000  -0.126889456
   58   2.8500   0.1400  -0.610000   1.7660   1.5600   0.020110767  -0.896042159
   59   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   65   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   66   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   67   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   68   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   74   3.5000   0.0660   0.080000   1.9750   1.7500   0.005000000  -0.741685710
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   2.8500   0.1400  -0.610000   1.7660   1.5600   0.020110767  -0.896042159
   78   3.7400   0.2000   1.760000   2.1070   1.8700   0.005000000   0.000000000
   79   2.9800   0.2000  -0.970000   1.6890   1.4900   0.001000000  -0.126889456
   80   2.9800   0.2000  -0.970000   1.6890   1.4900   0.001000000  -0.126889456
   81   2.8500   0.1400  -0.610000   1.7660   1.5600   0.020110767  -0.896042159
   82   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   88   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   89   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   90   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   91   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   97   3.5000   0.0660   0.080000   1.9750   1.7500   0.005000000  -0.741685710
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   2.9000   0.1400  -1.312500   1.7660   1.5600   0.020110767  -0.896042159
  101   3.7400   0.2000   0.937500   2.1070   1.8700   0.005000000   0.000000000
  102   2.9800   0.2000  -0.912500   1.6890   1.4900   0.001000000  -0.126889456
  103   2.9800   0.2000  -0.912500   1.6890   1.4900   0.001000000  -0.126889456
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   268.000  1.529
   33    49   268.000  1.529
   38    39   340.000  1.090
   38    40   268.000  1.529
   38    42   320.000  1.410
   40    41   340.000  1.090
   40    44   320.000  1.410
   40    45   268.000  1.529
   44    49   320.000  1.410
   49    50   340.000  1.090
   49    51   268.000  1.529
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    54   320.000  1.410
   54    55   230.000  1.697
   55    56   525.000  1.480
   55    57   525.000  1.480
   55    58   230.000  1.697
   58    59   320.000  1.410
   59    60   340.000  1.090
   59    61   268.000  1.529
   59    72   268.000  1.529
   61    62   340.000  1.090
   61    63   268.000  1.529
   61    65   320.000  1.410
   63    64   340.000  1.090
   63    67   320.000  1.410
   63    68   268.000  1.529
   67    72   320.000  1.410
   72    73   340.000  1.090
   72    74   268.000  1.529
   74    75   340.000  1.090
   74    76   340.000  1.090
   74    77   320.000  1.410
   77    78   230.000  1.697
   78    79   525.000  1.480
   78    80   525.000  1.480
   78    81   230.000  1.697
   81    82   320.000  1.410
   82    83   340.000  1.090
   82    84   268.000  1.529
   82    95   268.000  1.529
   84    85   340.000  1.090
   84    86   268.000  1.529
   84    88   320.000  1.410
   86    87   340.000  1.090
   86    90   320.000  1.410
   86    91   268.000  1.529
   90    95   320.000  1.410
   95    96   340.000  1.090
   95    97   268.000  1.529
   97    98   340.000  1.090
   97    99   340.000  1.090
   97   100   320.000  1.410
  100   101   325.000  1.672
  101   102   325.000  1.672
  101   103   325.000  1.672
   91    92   340.000  1.090
   91    93   340.000  1.090
   91    94   340.000  1.090
   88    89   553.000  0.945
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    71   340.000  1.090
   65    66   553.000  0.945
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   340.000  1.090
   42    43   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    49    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    58.35000  112.70000
   33    38    42    50.00000  109.50000
   33    49    44    50.00000  109.50000
   33    49    50    37.50000  110.70000
   33    49    51    58.35000  112.70000
   38    33    34    37.50000  110.70000
   38    40    41    37.50000  110.70000
   38    40    44    50.00000  109.50000
   38    40    45    58.35000  112.70000
   38    42    43    55.00000  108.50000
   40    38    39    37.50000  110.70000
   40    44    49    60.00000  109.50000
   40    45    46    37.50000  110.70000
   40    45    47    37.50000  110.70000
   40    45    48    37.50000  110.70000
   44    40    41    35.00000  109.50000
   44    49    50    35.00000  109.50000
   44    49    51    50.00000  109.50000
   49    33    34    37.50000  110.70000
   49    33    38    58.35000  112.70000
   49    51    52    37.50000  110.70000
   49    51    53    37.50000  110.70000
   49    51    54    50.00000  109.50000
   51    49    50    37.50000  110.70000
   51    54    55   100.00000  120.50000
   53    51    52    33.00000  107.80000
   54    51    52    35.00000  109.50000
   54    51    53    35.00000  109.50000
   54    55    56   100.00000  108.23000
   54    55    57   100.00000  108.23000
   54    55    58    45.00000  102.60000
   55    58    59   100.00000  120.50000
   57    55    56   140.00000  119.90000
   58    55    56   100.00000  108.23000
   58    55    57   100.00000  108.23000
   58    59    60    35.00000  109.50000
   58    59    61    50.00000  109.50000
   58    59    72    50.00000  109.50000
   59    61    62    37.50000  110.70000
   59    61    63    58.35000  112.70000
   59    61    65    50.00000  109.50000
   59    72    67    50.00000  109.50000
   59    72    73    37.50000  110.70000
   59    72    74    58.35000  112.70000
   61    59    60    37.50000  110.70000
   61    63    64    37.50000  110.70000
   61    63    67    50.00000  109.50000
   61    63    68    58.35000  112.70000
   61    65    66    55.00000  108.50000
   63    61    62    37.50000  110.70000
   63    67    72    60.00000  109.50000
   63    68    69    37.50000  110.70000
   63    68    70    37.50000  110.70000
   63    68    71    37.50000  110.70000
   67    63    64    35.00000  109.50000
   67    72    73    35.00000  109.50000
   67    72    74    50.00000  109.50000
   72    59    60    37.50000  110.70000
   72    59    61    58.35000  112.70000
   72    74    75    37.50000  110.70000
   72    74    76    37.50000  110.70000
   72    74    77    50.00000  109.50000
   74    72    73    37.50000  110.70000
   74    77    78   100.00000  120.50000
   76    74    75    33.00000  107.80000
   77    74    75    35.00000  109.50000
   77    74    76    35.00000  109.50000
   77    78    79   100.00000  108.23000
   77    78    80   100.00000  108.23000
   77    78    81    45.00000  102.60000
   78    81    82   100.00000  120.50000
   80    78    79   140.00000  119.90000
   81    78    79   100.00000  108.23000
   81    78    80   100.00000  108.23000
   81    82    83    35.00000  109.50000
   81    82    84    50.00000  109.50000
   81    82    95    50.00000  109.50000
   82    84    85    37.50000  110.70000
   82    84    86    58.35000  112.70000
   82    84    88    50.00000  109.50000
   82    95    90    50.00000  109.50000
   82    95    96    37.50000  110.70000
   82    95    97    58.35000  112.70000
   84    82    83    37.50000  110.70000
   84    86    87    37.50000  110.70000
   84    86    90    50.00000  109.50000
   84    86    91    58.35000  112.70000
   84    88    89    55.00000  108.50000
   86    84    85    37.50000  110.70000
   86    90    95    60.00000  109.50000
   86    91    92    37.50000  110.70000
   86    91    93    37.50000  110.70000
   86    91    94    37.50000  110.70000
   90    86    87    35.00000  109.50000
   90    95    96    35.00000  109.50000
   90    95    97    50.00000  109.50000
   95    82    83    37.50000  110.70000
   95    82    84    58.35000  112.70000
   95    97    98    37.50000  110.70000
   95    97    99    37.50000  110.70000
   95    97   100    50.00000  109.50000
   97    95    96    37.50000  110.70000
   97   100   101   100.00000  120.50000
   99    97    98    33.00000  107.80000
  100    97    98    35.00000  109.50000
  100    97    99    35.00000  109.50000
  100   101   102    45.00000  102.60000
  100   101   103    45.00000  102.60000
  103   101   102    35.00000   94.00000
   91    86    87    37.50000  110.70000
   91    86    90    50.00000  109.50000
   93    91    92    33.00000  107.80000
   94    91    92    33.00000  107.80000
   94    91    93    33.00000  107.80000
   88    84    85    35.00000  109.50000
   88    84    86    50.00000  109.50000
   68    63    64    37.50000  110.70000
   68    63    67    50.00000  109.50000
   70    68    69    33.00000  107.80000
   71    68    69    33.00000  107.80000
   71    68    70    33.00000  107.80000
   65    61    62    35.00000  109.50000
   65    61    63    50.00000  109.50000
   45    40    41    37.50000  110.70000
   45    40    44    50.00000  109.50000
   47    45    46    33.00000  107.80000
   48    45    46    33.00000  107.80000
   48    45    47    33.00000  107.80000
   42    38    39    35.00000  109.50000
   42    38    40    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    49   0.01700  1.0 1.0
   24    29    33    49  -0.23550 -1.0 2.0
   24    29    33    49   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    40   0.44750  1.0 1.0
   29    33    38    40  -0.17800 -1.0 2.0
   29    33    38    40   0.20200  1.0 3.0
   29    33    38    42   0.56750  1.0 1.0
   29    33    38    42  -0.07550 -1.0 2.0
   29    33    38    42   0.20000  1.0 3.0
   29    33    49    44   0.56750  1.0 1.0
   29    33    49    44  -0.07550 -1.0 2.0
   29    33    49    44   0.20000  1.0 3.0
   29    33    49    50   0.15000  1.0 3.0
   29    33    49    51   0.44750  1.0 1.0
   29    33    49    51  -0.17800 -1.0 2.0
   29    33    49    51   0.20200  1.0 3.0
   33    38    40    41   0.15000  1.0 3.0
   33    38   -40    44   0.62750  1.0 1.0
   33    38   -40    44  -0.30950 -1.0 2.0
   33    38   -40    44   0.27300  1.0 3.0
   33    38    40    45   0.56750  1.0 1.0
   33    38    40    45  -0.07550 -1.0 2.0
   33    38    40    45   0.20000  1.0 3.0
   33    38    42    43  -0.11600  1.0 1.0
   33    38    42    43  -0.09450 -1.0 2.0
   33    38    42    43   0.21250  1.0 3.0
   33    49    51    52   0.15000  1.0 3.0
   33    49    51    53   0.15000  1.0 3.0
   33    49    51    54   0.62750  1.0 1.0
   33    49    51    54  -0.30950 -1.0 2.0
   33    49    51    54   0.27300  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    42   0.23400  1.0 3.0
   34    33    49    44   0.23400  1.0 3.0
   34    33    49    50   0.15000  1.0 3.0
   34    33    49    51   0.15000  1.0 3.0
   38    33   -49    44   0.62750  1.0 1.0
   38    33   -49    44  -0.30950 -1.0 2.0
   38    33   -49    44   0.27300  1.0 3.0
   38    33    49    50   0.15000  1.0 3.0
   38    33    49    51   0.56750  1.0 1.0
   38    33    49    51  -0.07550 -1.0 2.0
   38    33    49    51   0.20000  1.0 3.0
   38    40   -44    49   0.06250  1.0 1.0
   38    40   -44    49  -0.01100 -1.0 2.0
   38    40   -44    49   0.28050  1.0 3.0
   38    40    45    46   0.15000  1.0 3.0
   38    40    45    47   0.15000  1.0 3.0
   38    40    45    48   0.15000  1.0 3.0
   39    38    40    41   0.15000  1.0 3.0
   39    38    40    44   0.23400  1.0 3.0
   39    38    40    45   0.15000  1.0 3.0
   39    38    42    43   0.19450  1.0 3.0
   40    38    42    43  -0.11600  1.0 1.0
   40    38    42    43  -0.09450 -1.0 2.0
   40    38    42    43   0.21250  1.0 3.0
   40    44   -49    33   0.06250  1.0 1.0
   40    44   -49    33  -0.01100 -1.0 2.0
   40    44   -49    33   0.28050  1.0 3.0
   40    44    49    50   0.37050  1.0 3.0
   40    44    49    51   0.06250  1.0 1.0
   40    44    49    51  -0.01100 -1.0 2.0
   40    44    49    51   0.28050  1.0 3.0
   41    40    44    49   0.37050  1.0 3.0
   41    40    45    46   0.15000  1.0 3.0
   41    40    45    47   0.15000  1.0 3.0
   41    40    45    48   0.15000  1.0 3.0
   44    40    45    46   0.23400  1.0 3.0
   44    40    45    47   0.23400  1.0 3.0
   44    40    45    48   0.23400  1.0 3.0
   44    49    51    52   0.23400  1.0 3.0
   44    49    51    53   0.23400  1.0 3.0
   44    49    51    54   1.11900  1.0 1.0
   44    49    51    54  -1.16350 -1.0 2.0
   44    49    51    54  -0.34150  1.0 3.0
   49    33    38    39   0.15000  1.0 3.0
   49    33   -38    40   0.56750  1.0 1.0
   49    33   -38    40  -0.07550 -1.0 2.0
   49    33   -38    40   0.20000  1.0 3.0
   49    33    38    42   0.86500  1.0 1.0
   49    33    38    42  -0.17500 -1.0 2.0
   49    33    38    42   0.20800  1.0 3.0
   49    51    54    55  -2.65550  1.0 1.0
   49    51    54    55  -0.22350 -1.0 2.0
   49    51    54    55   0.24150  1.0 3.0
   50    49    51    52   0.15000  1.0 3.0
   50    49    51    53   0.15000  1.0 3.0
   50    49    51    54   0.23400  1.0 3.0
   51    54    55    56   0.00000  1.0 1.0
   51    54    55    57   0.00000  1.0 1.0
   51    54    55    58   0.05050  1.0 1.0
   51    54    55    58  -1.30700 -1.0 2.0
   51    54    55    58   0.91550  1.0 3.0
   52    51    54    55   0.03000  1.0 3.0
   53    51    54    55   0.03000  1.0 3.0
   54    55    58    59   0.05050  1.0 1.0
   54    55    58    59  -1.30700 -1.0 2.0
   54    55    58    59   0.91550  1.0 3.0
   55    58    59    60   0.03000  1.0 3.0
   55    58    59    61  -2.65550  1.0 1.0
   55    58    59    61  -0.22350 -1.0 2.0
   55    58    59    61   0.24150  1.0 3.0
   55    58    59    72  -2.65550  1.0 1.0
   55    58    59    72  -0.22350 -1.0 2.0
   55    58    59    72   0.24150  1.0 3.0
   56    55    58    59   0.00000  1.0 1.0
   57    55    58    59   0.00000  1.0 1.0
   58    59    61    62   0.23400  1.0 3.0
   58    59    61    63   0.62750  1.0 1.0
   58    59    61    63  -0.30950 -1.0 2.0
   58    59    61    63   0.27300  1.0 3.0
   58    59    61    65   3.69350  1.0 1.0
   58    59    61    65  -1.82950 -1.0 2.0
   58    59    72    67   1.11900  1.0 1.0
   58    59    72    67  -1.16350 -1.0 2.0
   58    59    72    67  -0.34150  1.0 3.0
   58    59    72    73   0.23400  1.0 3.0
   58    59    72    74   0.62750  1.0 1.0
   58    59    72    74  -0.30950 -1.0 2.0
   58    59    72    74   0.27300  1.0 3.0
   59    61    63    64   0.15000  1.0 3.0
   59    61   -63    67   0.62750  1.0 1.0
   59    61   -63    67  -0.30950 -1.0 2.0
   59    61   -63    67   0.27300  1.0 3.0
   59    61    63    68   0.56750  1.0 1.0
   59    61    63    68  -0.07550 -1.0 2.0
   59    61    63    68   0.20000  1.0 3.0
   59    61    65    66  -0.11600  1.0 1.0
   59    61    65    66  -0.09450 -1.0 2.0
   59    61    65    66   0.21250  1.0 3.0
   59    72    74    75   0.15000  1.0 3.0
   59    72    74    76   0.15000  1.0 3.0
   59    72    74    77   0.62750  1.0 1.0
   59    72    74    77  -0.30950 -1.0 2.0
   59    72    74    77   0.27300  1.0 3.0
   60    59    61    62   0.15000  1.0 3.0
   60    59    61    63   0.15000  1.0 3.0
   60    59    61    65   0.23400  1.0 3.0
   60    59    72    67   0.23400  1.0 3.0
   60    59    72    73   0.15000  1.0 3.0
   60    59    72    74   0.15000  1.0 3.0
   61    59   -72    67   0.62750  1.0 1.0
   61    59   -72    67  -0.30950 -1.0 2.0
   61    59   -72    67   0.27300  1.0 3.0
   61    59    72    73   0.15000  1.0 3.0
   61    59    72    74   0.56750  1.0 1.0
   61    59    72    74  -0.07550 -1.0 2.0
   61    59    72    74   0.20000  1.0 3.0
   61    63   -67    72   0.06250  1.0 1.0
   61    63   -67    72  -0.01100 -1.0 2.0
   61    63   -67    72   0.28050  1.0 3.0
   61    63    68    69   0.15000  1.0 3.0
   61    63    68    70   0.15000  1.0 3.0
   61    63    68    71   0.15000  1.0 3.0
   62    61    63    64   0.15000  1.0 3.0
   62    61    63    67   0.23400  1.0 3.0
   62    61    63    68   0.15000  1.0 3.0
   62    61    65    66   0.19450  1.0 3.0
   63    61    65    66  -0.11600  1.0 1.0
   63    61    65    66  -0.09450 -1.0 2.0
   63    61    65    66   0.21250  1.0 3.0
   63    67   -72    59   0.06250  1.0 1.0
   63    67   -72    59  -0.01100 -1.0 2.0
   63    67   -72    59   0.28050  1.0 3.0
   63    67    72    73   0.37050  1.0 3.0
   63    67    72    74   0.06250  1.0 1.0
   63    67    72    74  -0.01100 -1.0 2.0
   63    67    72    74   0.28050  1.0 3.0
   64    63    67    72   0.37050  1.0 3.0
   64    63    68    69   0.15000  1.0 3.0
   64    63    68    70   0.15000  1.0 3.0
   64    63    68    71   0.15000  1.0 3.0
   67    63    68    69   0.23400  1.0 3.0
   67    63    68    70   0.23400  1.0 3.0
   67    63    68    71   0.23400  1.0 3.0
   67    72    74    75   0.23400  1.0 3.0
   67    72    74    76   0.23400  1.0 3.0
   67    72    74    77   1.11900  1.0 1.0
   67    72    74    77  -1.16350 -1.0 2.0
   67    72    74    77  -0.34150  1.0 3.0
   72    59    61    62   0.15000  1.0 3.0
   72    59   -61    63   0.56750  1.0 1.0
   72    59   -61    63  -0.07550 -1.0 2.0
   72    59   -61    63   0.20000  1.0 3.0
   72    59    61    65   0.86500  1.0 1.0
   72    59    61    65  -0.17500 -1.0 2.0
   72    59    61    65   0.20800  1.0 3.0
   72    74    77    78  -2.65550  1.0 1.0
   72    74    77    78  -0.22350 -1.0 2.0
   72    74    77    78   0.24150  1.0 3.0
   73    72    74    75   0.15000  1.0 3.0
   73    72    74    76   0.15000  1.0 3.0
   73    72    74    77   0.23400  1.0 3.0
   74    77    78    79   0.00000  1.0 1.0
   74    77    78    80   0.00000  1.0 1.0
   74    77    78    81   0.05050  1.0 1.0
   74    77    78    81  -1.30700 -1.0 2.0
   74    77    78    81   0.91550  1.0 3.0
   75    74    77    78   0.03000  1.0 3.0
   76    74    77    78   0.03000  1.0 3.0
   77    78    81    82   0.05050  1.0 1.0
   77    78    81    82  -1.30700 -1.0 2.0
   77    78    81    82   0.91550  1.0 3.0
   78    81    82    83   0.03000  1.0 3.0
   78    81    82    84  -2.65550  1.0 1.0
   78    81    82    84  -0.22350 -1.0 2.0
   78    81    82    84   0.24150  1.0 3.0
   78    81    82    95  -2.65550  1.0 1.0
   78    81    82    95  -0.22350 -1.0 2.0
   78    81    82    95   0.24150  1.0 3.0
   79    78    81    82   0.00000  1.0 1.0
   80    78    81    82   0.00000  1.0 1.0
   81    82    84    85   0.23400  1.0 3.0
   81    82    84    86   0.62750  1.0 1.0
   81    82    84    86  -0.30950 -1.0 2.0
   81    82    84    86   0.27300  1.0 3.0
   81    82    84    88   3.69350  1.0 1.0
   81    82    84    88  -1.82950 -1.0 2.0
   81    82    95    90   1.11900  1.0 1.0
   81    82    95    90  -1.16350 -1.0 2.0
   81    82    95    90  -0.34150  1.0 3.0
   81    82    95    96   0.23400  1.0 3.0
   81    82    95    97   0.62750  1.0 1.0
   81    82    95    97  -0.30950 -1.0 2.0
   81    82    95    97   0.27300  1.0 3.0
   82    84    86    87   0.15000  1.0 3.0
   82    84   -86    90   0.62750  1.0 1.0
   82    84   -86    90  -0.30950 -1.0 2.0
   82    84   -86    90   0.27300  1.0 3.0
   82    84    86    91   0.56750  1.0 1.0
   82    84    86    91  -0.07550 -1.0 2.0
   82    84    86    91   0.20000  1.0 3.0
   82    84    88    89  -0.11600  1.0 1.0
   82    84    88    89  -0.09450 -1.0 2.0
   82    84    88    89   0.21250  1.0 3.0
   82    95    97    98   0.15000  1.0 3.0
   82    95    97    99   0.15000  1.0 3.0
   82    95    97   100   0.62750  1.0 1.0
   82    95    97   100  -0.30950 -1.0 2.0
   82    95    97   100   0.27300  1.0 3.0
   83    82    84    85   0.15000  1.0 3.0
   83    82    84    86   0.15000  1.0 3.0
   83    82    84    88   0.23400  1.0 3.0
   83    82    95    90   0.23400  1.0 3.0
   83    82    95    96   0.15000  1.0 3.0
   83    82    95    97   0.15000  1.0 3.0
   84    82   -95    90   0.62750  1.0 1.0
   84    82   -95    90  -0.30950 -1.0 2.0
   84    82   -95    90   0.27300  1.0 3.0
   84    82    95    96   0.15000  1.0 3.0
   84    82    95    97   0.56750  1.0 1.0
   84    82    95    97  -0.07550 -1.0 2.0
   84    82    95    97   0.20000  1.0 3.0
   84    86   -90    95   0.06250  1.0 1.0
   84    86   -90    95  -0.01100 -1.0 2.0
   84    86   -90    95   0.28050  1.0 3.0
   84    86    91    92   0.15000  1.0 3.0
   84    86    91    93   0.15000  1.0 3.0
   84    86    91    94   0.15000  1.0 3.0
   85    84    86    87   0.15000  1.0 3.0
   85    84    86    90   0.23400  1.0 3.0
   85    84    86    91   0.15000  1.0 3.0
   85    84    88    89   0.19450  1.0 3.0
   86    84    88    89  -0.11600  1.0 1.0
   86    84    88    89  -0.09450 -1.0 2.0
   86    84    88    89   0.21250  1.0 3.0
   86    90   -95    82   0.06250  1.0 1.0
   86    90   -95    82  -0.01100 -1.0 2.0
   86    90   -95    82   0.28050  1.0 3.0
   86    90    95    96   0.37050  1.0 3.0
   86    90    95    97   0.06250  1.0 1.0
   86    90    95    97  -0.01100 -1.0 2.0
   86    90    95    97   0.28050  1.0 3.0
   87    86    90    95   0.37050  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    94   0.15000  1.0 3.0
   90    86    91    92   0.23400  1.0 3.0
   90    86    91    93   0.23400  1.0 3.0
   90    86    91    94   0.23400  1.0 3.0
   90    95    97    98   0.23400  1.0 3.0
   90    95    97    99   0.23400  1.0 3.0
   90    95    97   100   1.11900  1.0 1.0
   90    95    97   100  -1.16350 -1.0 2.0
   90    95    97   100  -0.34150  1.0 3.0
   95    82    84    85   0.15000  1.0 3.0
   95    82   -84    86   0.56750  1.0 1.0
   95    82   -84    86  -0.07550 -1.0 2.0
   95    82   -84    86   0.20000  1.0 3.0
   95    82    84    88   0.86500  1.0 1.0
   95    82    84    88  -0.17500 -1.0 2.0
   95    82    84    88   0.20800  1.0 3.0
   95    97   100   101  -2.65550  1.0 1.0
   95    97   100   101  -0.22350 -1.0 2.0
   95    97   100   101   0.24150  1.0 3.0
   96    95    97    98   0.15000  1.0 3.0
   96    95    97    99   0.15000  1.0 3.0
   96    95    97   100   0.23400  1.0 3.0
   97   100   101   102   0.05050  1.0 1.0
   97   100   101   102  -1.30700 -1.0 2.0
   97   100   101   102   0.91550  1.0 3.0
   97   100   101   103   0.05050  1.0 1.0
   97   100   101   103  -1.30700 -1.0 2.0
   97   100   101   103   0.91550  1.0 3.0
   98    97   100   101   0.03000  1.0 3.0
   99    97   100   101   0.03000  1.0 3.0
   91    86    90    95   0.06250  1.0 1.0
   91    86    90    95  -0.01100 -1.0 2.0
   91    86    90    95   0.28050  1.0 3.0
   88    84    86    87   0.23400  1.0 3.0
   88    84    86    90   3.69350  1.0 1.0
   88    84    86    90  -1.82950 -1.0 2.0
   88    84    86    91   0.86500  1.0 1.0
   88    84    86    91  -0.17500 -1.0 2.0
   88    84    86    91   0.20800  1.0 3.0
   68    63    67    72   0.06250  1.0 1.0
   68    63    67    72  -0.01100 -1.0 2.0
   68    63    67    72   0.28050  1.0 3.0
   65    61    63    64   0.23400  1.0 3.0
   65    61    63    67   3.69350  1.0 1.0
   65    61    63    67  -1.82950 -1.0 2.0
   65    61    63    68   0.86500  1.0 1.0
   65    61    63    68  -0.17500 -1.0 2.0
   65    61    63    68   0.20800  1.0 3.0
   45    40    44    49   0.06250  1.0 1.0
   45    40    44    49  -0.01100 -1.0 2.0
   45    40    44    49   0.28050  1.0 3.0
   42    38    40    41   0.23400  1.0 3.0
   42    38    40    44   3.69350  1.0 1.0
   42    38    40    44  -1.82950 -1.0 2.0
   42    38    40    45   0.86500  1.0 1.0
   42    38    40    45  -0.17500 -1.0 2.0
   42    38    40    45   0.20800  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
END
