* LIGAND DATABASE FILE (OPLS2005)
*
001     102   103    185    278     534
    1     0 S   NP   _N1_     1    29.37081    93.17428   -24.57838
    2     1 S   H    _HN1     2     1.02834    21.37358  -164.38094
    3     1 S   H    _H1_     3     1.02782   112.98510   -84.12151
    4     1 S   H    _H2_     4     1.02957    85.92837    24.09918
    5     1 S   CT   _CA1     5     1.50115   123.04503   135.87090
    6     5 S   HC   _HA1     6     1.09573   105.22859    78.94617
    7     5 S   CO3  _C1_     7     1.53800   112.39555   -41.30914
    8     7 S   O2Z  _O11     8     1.26369   115.00291   -43.50947
    9     7 S   O2Z  _O12     9     1.26237   114.94473   135.65925
   10     5 S   CT   _CB1    10     1.53091   107.42344  -163.08070
   11    10 S   HC   HB11    11     1.09828   109.39283   -50.02446
   12    10 S   HC   HB12    12     1.09826   110.42596    66.56496
   13    10 S   CT   _CG1    13     1.53000   112.62630  -171.06042
   14    13 S   HC   HG11    14     1.09590   110.50184   -63.78079
   15    13 S   HC   HG12    15     1.09657   109.95106    55.47967
   16    13 S   C    _CD1    16     1.51775   112.25954   175.88006
   17    16 S   O    _OE1    17     1.22745   123.27205     0.61166
   18    16 S   N    _N2_    18     1.38660   111.66868  -179.50703
   19    18 S   H    _HN2    19     1.01599   119.07125     1.07374
   20    18 S   CT1  _CA2    20     1.46083   123.22351   179.67857
   21    20 S   HC   _HA2    21     1.09562   109.16417    -9.29976
   22    20 S   C    _C2_    22     1.53411   108.70107  -124.28513
   23    22 S   O    _O2_    23     1.23035   122.29472  -149.21231
   24    20 S   CT   _CB2    32     1.53396   111.84933   113.12631
   25    24 S   HC   HB21    33     1.09654   109.56400    62.99692
   26    24 S   HC   HB22    34     1.09569   110.92718  -179.65338
   27    22 S   N    _N3_    24     1.38347   113.51158    38.40092
   28    27 S   H    _HN3    25     1.01639   119.49051    -3.77605
   29    24 S   S    _SG2    35     1.82867   114.55681   -56.64687
   30    27 S   CT   _CA3    26     1.45284   123.14790   176.84980
   31    30 S   HC   HA31    27     1.09553   107.56178   -63.03054
   32    30 S   HC   HA32    28     1.09558   107.91210    53.37874
   33    29 S   CT   _C17    36     1.83204    99.88851   -69.18194
   34    33 S   HC   _H20    37     1.09311   105.45463   -62.25588
   35    33 S   HC   _H21    38     1.09322   109.06819    54.25000
   36    30 S   CO3  _C3_    29     1.52939   114.11614   175.34129
   37    36 S   O2Z  _O31    30     1.26368   116.04896    -0.49772
   38    36 S   O2Z  _O32    31     1.26428   114.41527   179.55281
   39    33 S   CT   _C16    39     1.55151   113.93042   176.42084
   40    39 S   CT   _C15    40     1.55170   111.26367   -57.73242
   41    40 S   HC   _H18    41     1.09604   110.82906    66.21122
   42    40 S   HC   _H19    42     1.09751   109.61579   -51.98817
   43    39 S   OH   _O34   101     1.42968   108.92168    60.47105
   44    43 S   HO   _H22   102     0.97309   107.55498   -55.05465
   45    40 S   CT   _C14    43     1.52939   113.37480  -173.73293
   46    45 S   HC   _H16    44     1.09659   109.26478   177.11534
   47    45 S   HC   _H17    45     1.09724   110.43554   -67.52689
   48    45 S   CT   _C13    46     1.52862   111.44401    55.41038
   49    48 S   HC   _H6_    47     1.09843   109.76523    61.60317
   50    48 S   CT   _C12    48     1.54045   111.00762   -57.87946
   51    50 S   HC   _H5_    49     1.09820   108.94447   177.41987
   52    48 S   OS   _O35    79     1.44199   109.73275  -178.52329
   53    39 S   CT   _C11    50     1.56605   110.44923  -178.82430
   54    53 S   HC   _H4_    51     1.10240   105.04934    61.31764
   55    50 S   OS   _O39    74     1.43226   109.60618   -62.65340
   56    52 S   CO4  _C18    80     1.35882   117.34012   -83.56815
   57    56 S   O    _O36    81     1.22029   127.13916    -0.33630
   58    53 S   C3T  _C9_    52     1.53418   116.01845   -54.77601
   59    55 S   CT   _C28    75     1.42137   113.33207  -104.04200
   60    59 S   HC   _H31    76     1.09322   108.22402   178.83115
   61    59 S   HC   _H32    77     1.09306   111.22049    59.68249
   62    59 S   HC   _H33    78     1.09444   110.27912   -62.68757
   63    56 S   CM   _C19    82     1.47896   107.46467   179.67797
   64    63 S   HC   _H23    83     1.08498   118.13971    -0.08847
   65    58 S   C3T  _C8_    53     1.52938   116.28354   152.14812
   66    65 S   HC   _H3_    54     1.08360   117.65039     5.81224
   67    58 S   CT   _C10    70     1.50159   119.91215   -49.76226
   68    67 S   HC   _H13    71     1.09373   112.51623   179.81977
   69    67 S   HC   _H14    72     1.09289   111.46768    61.11959
   70    67 S   HC   _H15    73     1.09210   111.33314   -60.18413
   71    63 S   CM   _C20    84     1.33993   119.82299   179.94766
   72    71 S   HC   _H24    85     1.08765   120.35013    -0.00000
   73    58 S   O3T  _O33    55     1.44128   113.43878    88.24268
   74    65 S   CT   _C7_    56     1.49729   123.67351   157.25049
   75    74 S   HC   _H11    57     1.09481   108.78253   -66.46232
   76    74 S   HC   _H12    58     1.09702   110.77655    48.94880
   77    71 S   CM   _C21    86     1.44707   122.72573   180.00000
   78    77 S   HC   _H25    87     1.08794   117.00723     0.00000
   79    74 S   CM   _C6_    59     1.50484   113.76141   169.19342
   80    79 S   HC   _H10    60     1.08938   114.19973   -81.56909
   81    77 S   CM   _C22    88     1.34238   123.00012  -180.00000
   82    81 S   HC   _H26    89     1.08574   119.28442     0.05935
   83    79 S   CM   _C5_    61     1.34665   127.45247    99.79181
   84    81 S   CM   _C23    90     1.44792   122.72287   179.93744
   85    84 S   HC   _H27    91     1.08964   115.67315    -0.46772
   86    83 S   CT   _C4_    62     1.50533   120.55476   178.20758
   87    86 S   HC   _H7_    63     1.09495   110.29092   119.11348
   88    86 S   HC   _H8_    64     1.09498   110.20176  -121.06569
   89    86 S   HC   _H9_    65     1.09512   112.39266    -1.02144
   90    83 S   CT   _C29    66     1.50281   124.93174    -2.52026
   91    90 S   HC   _H34    67     1.09477   110.11408   113.70285
   92    90 S   HC   _H35    68     1.09543   110.06271  -126.95446
   93    90 S   HC   _H36    69     1.09256   113.41446    -7.43978
   94    84 S   CM   _C24    92     1.34348   127.70909   179.73830
   95    94 S   HC   _H28    93     1.08798   116.15404  -179.91844
   96    94 S   CM   _C25    94     1.44765   127.45632    -0.65641
   97    96 S   HC   _H29    95     1.08678   116.91385    -3.58938
   98    96 S   CM   _C26    96     1.34076   126.87222   178.00688
   99    98 S   HC   _H30    97     1.09061   117.46166   176.88059
  100    98 S   CO3  _C27    98     1.53213   126.04524    -1.47167
  101   100 S   O2Z  _O38    99     1.26507   114.13849   133.41380
  102   100 S   O2Z  _O37   100     1.26260   116.27439   -48.56966
  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   7   5   4   3
  13   5   4   2   1   1  18  14   7   6   6   1  10   5   4  12
   6  14   6   7  12   5   5   6   3  11   3   2   1   1   6   3
  12   6   5   3   2   1   6   3   4   7   4   3   6   3  10   3
   6   3   8   6   3   7   3   2   1   3   2   1   1   6   3   6
   3   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    53    43  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    45    50    53    54    58    43    44  
   35    39    40    53    43  
   39    40    53    43  
   37    38  
   38  
    0  
   40    41    42    45    46    47    48    50    51    53    54    58    65    73    67    55    43    44  
   41    42    45    46    47    48    49    50    53    54    58    52    43    44  
   42    45    46    47    48    53    43  
   45    46    47    48    53    43  
   44    45    50    53    54    58  
   53  
   46    47    48    49    50    51    53    55    52    56  
   47    48    49    50    52  
   48    49    50    52  
   49    50    51    53    54    58    55    59    52    56    57    63  
   50    51    53    55    52    56  
   51    53    54    58    65    73    67    55    59    60    61    62    52    56  
   53    54    58    55    59    52  
   56    57    63    64    71    53    55  
   54    58    65    66    73    74    67    68    69    70    55    59  
   58    65    73    67    55  
   59    60    61    62    58  
   57    63    64    71    72    77  
   63    64    71  
   65    66    73    74    75    76    79    67    68    69    70  
   60    61    62  
   61    62  
   62  
    0  
   64    71    72    77    78    81  
   71    72    77  
   66    73    74    75    76    79    80    83    67    68    69    70  
   73    74    75    76    79    67  
   68    69    70    73    74  
   69    70    73  
   70    73  
   73  
   72    77    78    81    82    84  
   77    78    81  
   74    75    76    79  
   75    76    79    80    83    86    90  
   76    79    80    83  
   79    80    83  
   78    81    82    84    85    94  
   81    82    84  
   80    83    86    87    88    89    90    91    92    93  
   83    86    90  
   82    84    85    94    95    96  
   84    85    94  
   86    87    88    89    90    91    92    93  
   85    94    95    96    97    98  
   94    95    96  
   87    88    89    90    91    92    93  
   88    89    90  
   89    90  
   90  
   91    92    93  
   92    93  
   93  
    0  
   95    96    97    98    99   100  
   96    97    98  
   97    98    99   100   101   102  
   98    99   100  
   99   100   101   102  
  100   101   102  
  101   102  
  102  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   40   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   44   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   45   3.5000   0.0660  -0.120000   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   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   50   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   52   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   53   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   56   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   58   3.5000   0.0660   0.176200   1.9750   1.7500   0.005000000  -0.741685710
   59   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   64   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   72   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   73   2.9000   0.1400  -0.352400   1.5900   1.4000   0.020110767  -0.896042159
   74   3.5000   0.0660  -0.120000   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   78   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   79   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   80   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   82   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   83   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   84   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   85   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   95   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   96   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   97   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   98   3.5500   0.0760  -0.425300   2.0020   1.7750   0.023028004  -0.852763146
   99   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  100   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
  101   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
  102   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   268.000  1.529
   39    40   268.000  1.529
   39    53   268.000  1.529
   39    43   320.000  1.410
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    45   268.000  1.529
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   268.000  1.529
   48    49   340.000  1.090
   48    50   268.000  1.529
   48    52   320.000  1.410
   50    51   340.000  1.090
   50    53   268.000  1.529
   50    55   320.000  1.410
   53    54   340.000  1.090
   53    58   275.000  1.510
   58    65   260.000  1.509
   58    73   335.000  1.432
   58    67   275.000  1.510
   65    66   340.000  1.088
   65    73   335.000  1.432
   65    74   275.000  1.510
   74    75   340.000  1.090
   74    76   340.000  1.090
   74    79   317.000  1.510
   79    80   340.000  1.080
   79    83   549.000  1.340
   83    86   317.000  1.510
   83    90   317.000  1.510
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    89   340.000  1.090
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    93   340.000  1.090
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   55    59   320.000  1.410
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   340.000  1.090
   52    56   214.000  1.327
   56    57   570.000  1.229
   56    63   320.000  1.462
   63    64   340.000  1.080
   63    71   549.000  1.340
   71    72   340.000  1.080
   71    77   380.000  1.444
   77    78   340.000  1.080
   77    81   549.000  1.340
   81    82   340.000  1.080
   81    84   380.000  1.444
   84    85   340.000  1.080
   84    94   549.000  1.340
   94    95   340.000  1.080
   94    96   380.000  1.444
   96    97   340.000  1.080
   96    98   549.000  1.340
   98    99   340.000  1.080
   98   100   230.000  1.545
  100   101   656.000  1.250
  100   102   656.000  1.250
   43    44   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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    58.35000  112.70000
   33    39    53    58.35000  112.70000
   33    39    43    50.00000  109.50000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    40    41    37.50000  110.70000
   39    40    42    37.50000  110.70000
   39    40    45    58.35000  112.70000
   39    53    50    58.35000  112.70000
   39    53    54    37.50000  110.70000
   39    53    58    70.00000  112.37300
   39    43    44    55.00000  108.50000
   40    45    46    37.50000  110.70000
   40    45    47    37.50000  110.70000
   40    45    48    58.35000  112.70000
   42    40    41    33.00000  107.80000
   45    40    41    37.50000  110.70000
   45    40    42    37.50000  110.70000
   45    48    49    37.50000  110.70000
   45    48    50    58.35000  112.70000
   45    48    52    50.00000  109.50000
   47    45    46    33.00000  107.80000
   48    45    46    37.50000  110.70000
   48    45    47    37.50000  110.70000
   48    50    51    37.50000  110.70000
   48    50    53    58.35000  112.70000
   48    50    55    50.00000  109.50000
   48    52    56    83.00000  116.90000
   50    48    49    37.50000  110.70000
   50    53    54    37.50000  110.70000
   50    53    58    70.00000  112.37300
   50    55    59    60.00000  109.50000
   53    39    40    58.35000  112.70000
   53    50    51    37.50000  110.70000
   53    58    65    60.00000  120.94000
   53    58    73    80.00000  116.47100
   53    58    67    58.35000  112.70000
   58    53    54    45.00000  109.38400
   58    65    66    37.50000  117.20000
   58    65    73    15.00000   60.43100
   58    65    74    60.00000  120.94000
   58    73    65    15.00000   59.14900
   58    67    68    45.00000  109.38400
   58    67    69    45.00000  109.38400
   58    67    70    45.00000  109.38400
   65    74    75    45.00000  109.38400
   65    74    76    45.00000  109.38400
   65    74    79    70.00000  112.02700
   73    58    65    15.00000   60.43100
   73    65    66    50.00000  114.27700
   74    65    66    40.00000  115.04500
   74    65    73    80.00000  116.47100
   74    79    80    35.00000  117.00000
   74    79    83    70.00000  124.00000
   76    74    75    33.00000  107.80000
   79    74    75    35.00000  109.50000
   79    74    76    35.00000  109.50000
   79    83    86    70.00000  124.00000
   79    83    90    70.00000  124.00000
   83    79    80    35.00000  120.00000
   83    86    87    35.00000  109.50000
   83    86    88    35.00000  109.50000
   83    86    89    35.00000  109.50000
   83    90    91    35.00000  109.50000
   83    90    92    35.00000  109.50000
   83    90    93    35.00000  109.50000
   88    86    87    33.00000  107.80000
   89    86    87    33.00000  107.80000
   89    86    88    33.00000  107.80000
   90    83    86    65.00000  117.92700
   92    90    91    33.00000  107.80000
   93    90    91    33.00000  107.80000
   93    90    92    33.00000  107.80000
   67    58    65    60.00000  120.94000
   67    58    73    80.00000  116.47100
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   55    50    51    35.00000  109.50000
   55    50    53    50.00000  109.50000
   55    59    60    35.00000  109.50000
   55    59    61    35.00000  109.50000
   55    59    62    35.00000  109.50000
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    33.00000  107.80000
   52    48    49    35.00000  109.50000
   52    48    50    50.00000  109.50000
   52    56    57    83.00000  123.40000
   52    56    63    90.00000  111.29400
   56    63    64    40.00000  117.72500
   56    63    71    65.00000  118.96000
   63    56    57    80.00000  123.72100
   63    71    72    35.00000  120.00000
   63    71    77    70.00000  123.01800
   71    63    64    35.00000  120.00000
   71    77    78    35.00000  120.00000
   71    77    81    70.00000  123.01800
   77    71    72    35.00000  120.00000
   77    81    82    35.00000  120.00000
   77    81    84    70.00000  123.01800
   81    77    78    35.00000  120.00000
   81    84    85    35.00000  120.00000
   81    84    94    70.00000  123.01800
   84    81    82    35.00000  120.00000
   84    94    95    35.00000  120.00000
   84    94    96    70.00000  123.01800
   94    84    85    35.00000  120.00000
   94    96    97    35.00000  120.00000
   94    96    98    70.00000  123.01800
   96    94    95    35.00000  120.00000
   96    98    99    35.00000  120.00000
   96    98   100    55.00000  124.75400
   98    96    97    35.00000  120.00000
   98   100   101    85.00000  113.83300
   98   100   102    85.00000  113.83300
  100    98    99    40.00000  118.53000
  102   100   101    80.00000  126.00000
   43    39    40    50.00000  109.50000
   43    39    53    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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    35   0.32350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   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    39    40   0.44750  1.0 1.0
   29    33    39    40  -0.17800 -1.0 2.0
   29    33    39    40   0.20200  1.0 3.0
   29    33    39    53   0.44750  1.0 1.0
   29    33    39    53  -0.17800 -1.0 2.0
   29    33    39    53   0.20200  1.0 3.0
   29    33    39    43   0.56750  1.0 1.0
   29    33    39    43  -0.07550 -1.0 2.0
   29    33    39    43   0.20000  1.0 3.0
   33    39    40    41   0.15000  1.0 3.0
   33    39    40    42   0.15000  1.0 3.0
   33    39    40    45   0.56750  1.0 1.0
   33    39    40    45  -0.07550 -1.0 2.0
   33    39    40    45   0.20000  1.0 3.0
   33    39    53    50   0.56750  1.0 1.0
   33    39    53    50  -0.07550 -1.0 2.0
   33    39    53    50   0.20000  1.0 3.0
   33    39    53    54   0.15000  1.0 3.0
   33    39    53    58   0.47050  1.0 1.0
   33    39    53    58   0.03900 -1.0 2.0
   33    39    53    58   0.20100  1.0 3.0
   33    39    43    44  -0.11600  1.0 1.0
   33    39    43    44  -0.09450 -1.0 2.0
   33    39    43    44   0.21250  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    53   0.15000  1.0 3.0
   34    33    39    43   0.23400  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    53   0.15000  1.0 3.0
   35    33    39    43   0.23400  1.0 3.0
   39    40    45    46   0.15000  1.0 3.0
   39    40    45    47   0.15000  1.0 3.0
   39    40    45    48   0.56750  1.0 1.0
   39    40    45    48  -0.07550 -1.0 2.0
   39    40    45    48   0.20000  1.0 3.0
   39    53    58    65   0.07850  1.0 1.0
   39    53    58    65  -0.03950 -1.0 2.0
   39    53    58    65   0.67350  1.0 3.0
   39    53    58    73   0.02550  1.0 1.0
   39    53    58    73  -0.02600 -1.0 2.0
   39    53    58    73   1.20400  1.0 3.0
   39    53    58    67   0.56750  1.0 1.0
   39    53    58    67  -0.07550 -1.0 2.0
   39    53    58    67   0.20000  1.0 3.0
   40    39    53    50   0.56750  1.0 1.0
   40    39    53    50  -0.07550 -1.0 2.0
   40    39    53    50   0.20000  1.0 3.0
   40    39    53    54   0.15000  1.0 3.0
   40    39    53    58   0.47050  1.0 1.0
   40    39    53    58   0.03900 -1.0 2.0
   40    39    53    58   0.20100  1.0 3.0
   40    39    43    44  -0.11600  1.0 1.0
   40    39    43    44  -0.09450 -1.0 2.0
   40    39    43    44   0.21250  1.0 3.0
   40    45    48    49   0.15000  1.0 3.0
   40    45   -48    50   0.56750  1.0 1.0
   40    45   -48    50  -0.07550 -1.0 2.0
   40    45   -48    50   0.20000  1.0 3.0
   40    45    48    52   0.62750  1.0 1.0
   40    45    48    52  -0.30950 -1.0 2.0
   40    45    48    52   0.27300  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
   42    40    45    46   0.15000  1.0 3.0
   42    40    45    47   0.15000  1.0 3.0
   42    40    45    48   0.15000  1.0 3.0
   45    48    50    51   0.15000  1.0 3.0
   45    48    50    53   0.56750  1.0 1.0
   45    48    50    53  -0.07550 -1.0 2.0
   45    48    50    53   0.20000  1.0 3.0
   45    48    50    55   0.62750  1.0 1.0
   45    48    50    55  -0.30950 -1.0 2.0
   45    48    50    55   0.27300  1.0 3.0
   45    48    52    56  -0.25900  1.0 1.0
   45    48    52    56  -0.47000 -1.0 2.0
   45    48    52    56   0.11750  1.0 3.0
   46    45    48    49   0.15000  1.0 3.0
   46    45    48    50   0.15000  1.0 3.0
   46    45    48    52   0.23400  1.0 3.0
   47    45    48    49   0.15000  1.0 3.0
   47    45    48    50   0.15000  1.0 3.0
   47    45    48    52   0.23400  1.0 3.0
   48    50   -53    39   0.56750  1.0 1.0
   48    50   -53    39  -0.07550 -1.0 2.0
   48    50   -53    39   0.20000  1.0 3.0
   48    50    53    54   0.15000  1.0 3.0
   48    50    53    58   0.47050  1.0 1.0
   48    50    53    58   0.03900 -1.0 2.0
   48    50    53    58   0.20100  1.0 3.0
   48    50    55    59   0.06250  1.0 1.0
   48    50    55    59  -0.01100 -1.0 2.0
   48    50    55    59   0.28050  1.0 3.0
   48    52    56    57   3.00000 -1.0 2.0
   48    52    56    63   2.00000 -1.0 2.0
   49    48    50    51   0.15000  1.0 3.0
   49    48    50    53   0.15000  1.0 3.0
   49    48    50    55   0.23400  1.0 3.0
   49    48    52    56   0.08050  1.0 3.0
   50    48    52    56  -0.25900  1.0 1.0
   50    48    52    56  -0.47000 -1.0 2.0
   50    48    52    56   0.11750  1.0 3.0
   50    53    58    65   0.07850  1.0 1.0
   50    53    58    65  -0.03950 -1.0 2.0
   50    53    58    65   0.67350  1.0 3.0
   50    53    58    73   0.02550  1.0 1.0
   50    53    58    73  -0.02600 -1.0 2.0
   50    53    58    73   1.20400  1.0 3.0
   50    53    58    67   0.56750  1.0 1.0
   50    53    58    67  -0.07550 -1.0 2.0
   50    53    58    67   0.20000  1.0 3.0
   50    55    59    60   0.37050  1.0 3.0
   50    55    59    61   0.37050  1.0 3.0
   50    55    59    62   0.37050  1.0 3.0
   51    50    53    39   0.15000  1.0 3.0
   51    50    53    54   0.15000  1.0 3.0
   51    50    53    58   0.15000  1.0 3.0
   51    50    55    59   0.37050  1.0 3.0
   53    39    40    41   0.15000  1.0 3.0
   53    39    40    42   0.15000  1.0 3.0
   53    39   -40    45   0.56750  1.0 1.0
   53    39   -40    45  -0.07550 -1.0 2.0
   53    39   -40    45   0.20000  1.0 3.0
   53    39    43    44  -0.11600  1.0 1.0
   53    39    43    44  -0.09450 -1.0 2.0
   53    39    43    44   0.21250  1.0 3.0
   53    50    55    59   0.06250  1.0 1.0
   53    50    55    59  -0.01100 -1.0 2.0
   53    50    55    59   0.28050  1.0 3.0
   53    58    65    66   0.15000  1.0 3.0
   53    58   -65    73   0.02550  1.0 1.0
   53    58   -65    73  -0.02600 -1.0 2.0
   53    58   -65    73   1.20400  1.0 3.0
   53    58    65    74   0.56750  1.0 1.0
   53    58    65    74  -0.07550 -1.0 2.0
   53    58    65    74   0.20000  1.0 3.0
   53    58   -73    65   0.06250  1.0 1.0
   53    58   -73    65  -0.01100 -1.0 2.0
   53    58   -73    65   0.28050  1.0 3.0
   53    58    67    68   0.15000  1.0 3.0
   53    58    67    69   0.15000  1.0 3.0
   53    58    67    70   0.15000  1.0 3.0
   54    53    58    65   0.15000  1.0 3.0
   54    53    58    73   0.23400  1.0 3.0
   54    53    58    67   0.15000  1.0 3.0
   58    65    74    75   0.15000  1.0 3.0
   58    65    74    76   0.15000  1.0 3.0
   58    65    74    79   0.34400  1.0 1.0
   58    65    74    79   0.09450 -1.0 2.0
   58    65    74    79   0.11100  1.0 3.0
   65    58    67    68   0.15000  1.0 3.0
   65    58    67    69   0.15000  1.0 3.0
   65    58    67    70   0.15000  1.0 3.0
   65    74    79    80   0.00000  1.0 1.0
   65    74    79    83   0.09850  1.0 1.0
   65    74    79    83   0.15250 -1.0 2.0
   65    74    79    83  -0.50650  1.0 3.0
   66    65   -73    58   0.36800  1.0 3.0
   66    65    74    75   0.15000  1.0 3.0
   66    65    74    76   0.15000  1.0 3.0
   66    65    74    79   0.15000  1.0 3.0
   73    58   -65    66   0.23400  1.0 3.0
   73    58   -65    74   0.02550  1.0 1.0
   73    58   -65    74  -0.02600 -1.0 2.0
   73    58   -65    74   1.20400  1.0 3.0
   73    58    67    68   0.23400  1.0 3.0
   73    58    67    69   0.23400  1.0 3.0
   73    58    67    70   0.23400  1.0 3.0
   73    65    74    75   0.23400  1.0 3.0
   73    65    74    76   0.23400  1.0 3.0
   73    65    74    79   0.61850  1.0 1.0
   73    65    74    79  -0.22750 -1.0 2.0
   73    65    74    79   0.15300  1.0 3.0
   74    65   -73    58   0.06250  1.0 1.0
   74    65   -73    58  -0.01100 -1.0 2.0
   74    65   -73    58   0.28050  1.0 3.0
   74    79    83    86   7.00000 -1.0 2.0
   74    79    83    90   7.00000 -1.0 2.0
   75    74    79    80   0.33100  1.0 3.0
   75    74    79    83   0.00000  1.0 1.0
   76    74    79    80   0.33100  1.0 3.0
   76    74    79    83   0.00000  1.0 1.0
   79    83    86    87   0.00000  1.0 1.0
   79    83    86    88   0.00000  1.0 1.0
   79    83    86    89   0.00000  1.0 1.0
   79    83    90    91   0.00000  1.0 1.0
   79    83    90    92   0.00000  1.0 1.0
   79    83    90    93   0.00000  1.0 1.0
   80    79    83    86   7.00000 -1.0 2.0
   80    79    83    90   7.00000 -1.0 2.0
   86    83    90    91   0.34800  1.0 3.0
   86    83    90    92   0.34800  1.0 3.0
   86    83    90    93   0.34800  1.0 3.0
   90    83    86    87   0.34800  1.0 3.0
   90    83    86    88   0.34800  1.0 3.0
   90    83    86    89   0.34800  1.0 3.0
   67    58    65    66   0.15000  1.0 3.0
   67    58   -65    73   0.02550  1.0 1.0
   67    58   -65    73  -0.02600 -1.0 2.0
   67    58   -65    73   1.20400  1.0 3.0
   67    58    65    74   0.56750  1.0 1.0
   67    58    65    74  -0.07550 -1.0 2.0
   67    58    65    74   0.20000  1.0 3.0
   67    58   -73    65   0.06250  1.0 1.0
   67    58   -73    65  -0.01100 -1.0 2.0
   67    58   -73    65   0.28050  1.0 3.0
   55    50    53    39   0.62750  1.0 1.0
   55    50    53    39  -0.30950 -1.0 2.0
   55    50    53    39   0.27300  1.0 3.0
   55    50    53    54   0.23400  1.0 3.0
   55    50    53    58  -0.26800  1.0 1.0
   55    50    53    58   0.69150 -1.0 2.0
   55    50    53    58  -0.48750  1.0 3.0
   52    48    50    51   0.23400  1.0 3.0
   52    48    50    53   0.62750  1.0 1.0
   52    48    50    53  -0.30950 -1.0 2.0
   52    48    50    53   0.27300  1.0 3.0
   52    48    50    55   1.11900  1.0 1.0
   52    48    50    55  -1.16350 -1.0 2.0
   52    48    50    55  -0.34150  1.0 3.0
   52    56    63    64   1.63100 -1.0 2.0
   52    56    63    71  -0.56150  1.0 1.0
   52    56    63    71   2.19150 -1.0 2.0
   56    63    71    72   7.00000 -1.0 2.0
   56    63    71    77   7.00000 -1.0 2.0
   57    56    63    64   0.00000  1.0 1.0
   57    56    63    71   1.00000 -1.0 2.0
   63    71    77    78  -0.18600  1.0 3.0
   63    71    77    81   0.28850  1.0 1.0
   63    71    77    81   2.61350 -1.0 2.0
   63    71    77    81   0.78400  1.0 3.0
   64    63    71    72   7.00000 -1.0 2.0
   64    63    71    77   7.00000 -1.0 2.0
   71    77    81    82   7.00000 -1.0 2.0
   71    77    81    84   7.00000 -1.0 2.0
   72    71    77    78   0.00000  1.0 1.0
   72    71    77    81  -0.18600  1.0 3.0
   77    81    84    85  -0.18600  1.0 3.0
   77    81    84    94   0.28850  1.0 1.0
   77    81    84    94   2.61350 -1.0 2.0
   77    81    84    94   0.78400  1.0 3.0
   78    77    81    82   7.00000 -1.0 2.0
   78    77    81    84   7.00000 -1.0 2.0
   81    84    94    95   7.00000 -1.0 2.0
   81    84    94    96   7.00000 -1.0 2.0
   82    81    84    85   0.00000  1.0 1.0
   82    81    84    94  -0.18600  1.0 3.0
   84    94    96    97  -0.18600  1.0 3.0
   84    94    96    98   0.28850  1.0 1.0
   84    94    96    98   2.61350 -1.0 2.0
   84    94    96    98   0.78400  1.0 3.0
   85    84    94    95   7.00000 -1.0 2.0
   85    84    94    96   7.00000 -1.0 2.0
   94    96    98    99   7.00000 -1.0 2.0
   94    96    98   100   7.00000 -1.0 2.0
   95    94    96    97   0.00000  1.0 1.0
   95    94    96    98  -0.18600  1.0 3.0
   96    98   100   101  -0.04000 -1.0 2.0
   96    98   100   101  -0.29050  1.0 3.0
   96    98   100   102  -0.04000 -1.0 2.0
   96    98   100   102  -0.29050  1.0 3.0
   97    96    98    99   7.00000 -1.0 2.0
   97    96    98   100   7.00000 -1.0 2.0
   99    98   100   101   0.00000  1.0 1.0
   99    98   100   102   0.00000  1.0 1.0
   43    39    40    41   0.23400  1.0 3.0
   43    39    40    42   0.23400  1.0 3.0
   43    39    40    45   0.86500  1.0 1.0
   43    39    40    45  -0.17500 -1.0 2.0
   43    39    40    45   0.20800  1.0 3.0
   43    39    53    50   0.86500  1.0 1.0
   43    39    53    50  -0.17500 -1.0 2.0
   43    39    53    50   0.20800  1.0 3.0
   43    39    53    54   0.23400  1.0 3.0
   43    39    53    58   0.86500  1.0 1.0
   43    39    53    58  -0.17500 -1.0 2.0
   43    39    53    58   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
   37    30    36    38  10.50000 -1.0 2.0
   74    80    79    83  15.00000 -1.0 2.0
   86    90    83    79  15.00000 -1.0 2.0
   52    63    56    57  10.50000 -1.0 2.0
   56    64    63    71  15.00000 -1.0 2.0
   77    72    71    63  15.00000 -1.0 2.0
   71    78    77    81  15.00000 -1.0 2.0
   84    82    81    77  15.00000 -1.0 2.0
   81    85    84    94  15.00000 -1.0 2.0
   96    95    94    84  15.00000 -1.0 2.0
   94    97    96    98  15.00000 -1.0 2.0
  100    99    98    96  15.00000 -1.0 2.0
  101    98   100   102  10.50000 -1.0 2.0
END
