* LIGAND DATABASE FILE (OPLS2005)
*
001     113   116    205    322     591
    1     0 S   NP   _N1_     1    30.58718   100.68404   -20.11609
    2     1 S   H    _HN1     2     1.03463   140.91236   -92.63714
    3     1 S   H    _H1_     3     1.02742    34.14142   -76.54446
    4     1 S   H    _H2_     4     1.02970    86.10376   154.19862
    5     1 S   CT   _CA1     5     1.50538    95.67400    44.26178
    6     5 S   HC   _HA1     6     1.09508   104.22476   147.22768
    7     5 S   CO3  _C1_     7     1.54469   112.38099    30.92026
    8     7 S   O2Z  _O11     8     1.26138   116.42215  -144.68206
    9     7 S   O2Z  _O12     9     1.26538   114.37814    35.22237
   10     5 S   CT   _CB1    10     1.53280   107.15947   -96.45146
   11    10 S   HC   HB11    11     1.09443   109.81653   -35.16455
   12    10 S   HC   HB12    12     1.09797   109.96402    80.38857
   13    10 S   CT   _CG1    13     1.53284   112.82391  -157.95540
   14    13 S   HC   HG11    14     1.09570   110.66155   -99.91023
   15    13 S   HC   HG12    15     1.09517   111.71119    19.08133
   16    13 S   C    _CD1    16     1.51528   110.93522   139.74687
   17    16 S   O    _OE1    17     1.22784   121.88123    99.28692
   18    16 S   N    _N2_    18     1.38603   112.64374   -79.76727
   19    18 S   H    _HN2    19     1.01568   119.13009     1.16163
   20    18 S   CT1  _CA2    20     1.46306   123.47869   178.83635
   21    20 S   HC   _HA2    21     1.09694   109.19463    -6.66468
   22    20 S   C    _C2_    22     1.53745   109.52093  -122.93706
   23    22 S   O    _O2_    23     1.23074   121.92695  -159.68301
   24    20 S   CT   _CB2    32     1.53673   111.62102   115.37529
   25    24 S   HC   HB21    33     1.09515   109.00065    60.29460
   26    24 S   HC   HB22    34     1.09401   109.89017   178.93909
   27    22 S   N    _N3_    24     1.38160   114.12484    26.31283
   28    27 S   H    _HN3    25     1.01399   119.02086    -0.83813
   29    24 S   S    _SG2    35     1.82743   111.83031   -60.06014
   30    27 S   CT   _CA3    26     1.45307   123.59205   179.67979
   31    30 S   HC   HA31    27     1.09547   107.07779   -73.30188
   32    30 S   HC   HA32    28     1.09540   108.50432    43.17966
   33    29 S   CT   _C24    36     1.87467   102.34053  -175.70408
   34    30 S   CO3  _C3_    29     1.53058   113.95368   165.03996
   35    34 S   O2Z  _O31    30     1.26461   116.09979   -17.13320
   36    34 S   O2Z  _O32    31     1.26392   114.52720   162.90258
   37    33 S   CM   _C23    37     1.53543   105.51257  -155.04017
   38    33 S   CT   _C29   110     1.53565   113.88529   -29.24935
   39    38 S   HC   _H24   111     1.09582   111.34388    73.57460
   40    38 S   HC   _H25   112     1.09255   113.26230   -47.55866
   41    38 S   HC   _H26   113     1.09700   110.89148  -167.85292
   42    37 S   N    _N7_    38     1.37394   108.07100   -99.91289
   43    42 S   H    _H20    39     1.01376   122.78368   172.90837
   44    37 S   CM   _C22    49     1.34585   132.19836    80.96692
   45    44 S   HC   _H19    50     1.08799   119.11819   176.41767
   46    42 S   C    _C26    40     1.38225   114.70556    -6.90342
   47    46 S   O    _O34    41     1.22129   126.54029   176.52802
   48    44 S   C5A  _C21    51     1.41441   124.76336    -0.90461
   49    33 S   CT   _C25    42     1.56997   112.27911    95.14907
   50    49 S   HC   _H3_    43     1.10160   108.54969  -158.07543
   51    48 S   C5BC _C20    52     1.38531   133.25432   121.91594
   52    49 S   CM   _C27    44     1.50229   119.06495   -32.84620
   53    52 S   HC   _H21    45     1.08769   118.20743    69.31298
   54    51 S   C5BC _C19    53     1.43897   107.10804  -178.80630
   55    51 S   CT   _C30   106     1.48815   126.07869    -1.15843
   56    55 S   HC   _H27   107     1.09458   110.14829   -86.48433
   57    55 S   HC   _H28   108     1.09479   111.14889    33.56637
   58    55 S   HC   _H29   109     1.09412   111.33543   153.18981
   59    52 S   CM   _C28    46     1.33847   123.73860  -112.32786
   60    59 S   HC   _H22    47     1.08479   120.45243  -179.20598
   61    59 S   HC   _H23    48     1.08454   121.66500     0.95593
   62    54 S   C5A  _C18    54     1.38752   107.01680    -3.13750
   63    54 S   CT   _C31    97     1.50036   126.62629   176.46116
   64    63 S   HC   _H30    98     1.09708   108.62489    50.34317
   65    63 S   HC   _H31    99     1.09629   110.07671   165.69919
   66    48 S   NA   _N6_    55     1.36960   119.09914   -61.69732
   67    66 S   H    _H18    56     1.01133   124.78781     2.07415
   68    62 S   CT   _C17    57     1.49536   131.77766   179.46478
   69    68 S   HC   _H16    58     1.09485   109.26936   -35.07450
   70    68 S   HC   _H17    59     1.09689   109.69586  -150.34336
   71    63 S   CT   _C32   100     1.52637   113.22391   -70.80949
   72    71 S   HC   _H32   101     1.09685   109.31358   175.42924
   73    71 S   HC   _H33   102     1.09609   110.97625    58.07280
   74    68 S   C5A  _C7_    60     1.49629   113.23973    88.20261
   75    71 S   CO3  _C33   103     1.52925   112.08608   -65.12446
   76    75 S   O2Z  _O36   104     1.26274   115.30586   -65.13754
   77    75 S   O2Z  _O35   105     1.26356   115.00000   115.78301
   78    74 S   C5BC _C6_    61     1.38831   131.16322  -129.17282
   79    78 S   C5BC _C5_    62     1.43757   107.22208  -177.39985
   80    78 S   CT   _C34    88     1.49996   126.85088     0.73329
   81    80 S   HC   _H34    89     1.09677   109.88454    36.15003
   82    80 S   HC   _H35    90     1.09709   109.27235   151.76787
   83    79 S   C5A  _C8_    63     1.38361   107.08102    -0.75615
   84    79 S   CT   _C4_    84     1.48810   126.24427   178.88408
   85    84 S   HC   _H4_    85     1.09464   110.10438    73.61313
   86    84 S   HC   _H5_    86     1.09443   111.74155  -166.23790
   87    84 S   HC   _H6_    87     1.09451   110.76134   -46.30914
   88    80 S   CT   _C35    91     1.52564   111.76413   -86.21099
   89    88 S   HC   _H36    92     1.09759   109.60308    63.61934
   90    88 S   HC   _H37    93     1.09733   109.62961   -53.37690
   91    74 S   NA   _N4_    64     1.37410   121.41195    53.99359
   92    91 S   H    _H7_    65     1.01067   124.65001    -1.28466
   93    83 S   CM   _C9_    66     1.41327   133.57965   176.39272
   94    93 S   HC   _H8_    67     1.08832   115.94332   -62.97775
   95    88 S   CO3  _C36    94     1.52901   115.73770  -174.45415
   96    95 S   O2Z  _O38    95     1.26575   113.86824   178.83601
   97    95 S   O2Z  _O37    96     1.26085   116.74088    -0.81661
   98    93 S   CM   _C10    68     1.34159   124.96652   116.66442
   99    98 S   CM   _C11    69     1.46398   132.86901    -1.99518
  100    99 S   CM   _C12    70     1.35306   109.13965   178.69929
  101    99 S   CM   _C15    79     1.45008   127.04826    -7.48275
  102   101 S   HC   _H13    80     1.08731   116.29544   -44.90568
  103   100 S   C    _C13    71     1.48753   107.23770    -0.62370
  104   103 S   O    _O33    72     1.21798   125.75267  -179.24775
  105   100 S   CT   _C14    75     1.48582   132.54862   175.22820
  106   105 S   HC   _H10    76     1.09440   110.22134   109.38238
  107   105 S   HC   _H11    77     1.09303   112.63114   -11.64016
  108   105 S   HC   _H12    78     1.09514   110.47476  -131.05392
  109   101 S   CM   _C16    81     1.33827   125.19071   133.07833
  110   109 S   HC   _H14    82     1.08488   120.11555  -179.18028
  111   109 S   HC   _H15    83     1.08460   122.27931     0.05595
  112    98 S   N    _N5_    73     1.36811   121.15539   176.78046
  113   112 S   H    _H9_    74     1.01295   123.91352     0.56993
  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  12   5   4   3
  17   2   1   1  16   9   3   2   1   9   4  10   3   6   3  11
   6   3  13   4   3  18   6   2   1   1   2   1   1  12  10   5
   4   5   1   9   4   3   5   4   3  11   2   1   1  16  14  11
   5   4  11   5   2   1   1   5   4   3   4   1   8   3   2   1
   1  10  14  11   7   3   7   3   4   2   1   1   2   1   1   1
   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    49    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    42    46    49    50    52    44    38    39    40    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    42    43    46    47    49    50    52    53    59    44    45    48    38    39    40    41  
   35    36  
   36  
    0  
   42    43    46    47    49    50    52    44    45    48    51    66    38    39    40    41  
   39    40    41    42    44    46    49    50    52  
   40    41    49  
   41    49  
   49  
   43    46    47    49    50    52    44    45    48  
   46    47    49    44  
   45    48    51    54    62    66    67    55    46    49  
   48    51    66  
   47    49    50    52    53    59  
   49    50    52  
   51    54    62    66    67    68    63    55    56    57    58  
   50    52    53    59    60    61  
   52    53    59  
   54    62    66    67    68    63    64    65    71    55    56    57    58  
   53    59    60    61  
   59    60    61  
   62    66    67    68    69    70    74    63    64    65    71    72    73    75    55    56    57    58  
   56    57    58    62    63    66  
   57    58  
   58  
    0  
   60    61  
   61  
    0  
   66    67    68    69    70    74    78    91    63    64    65    71  
   64    65    71    72    73    75    76    77    66    68  
   65    71    72    73    75  
   71    72    73    75  
   67    68    69    70    74  
   68  
   69    70    74    78    79    83    91    92    80  
   70    74    78    91  
   74    78    91  
   72    73    75    76    77  
   73    75    76    77  
   75    76    77  
   78    79    83    91    92    93    84    80    81    82    88  
   76    77  
   77  
    0  
   79    83    91    92    93    84    85    86    87    80    81    82    88    89    90    95  
   83    91    92    93    94    98    84    85    86    87    80    81    82    88  
   81    82    88    89    90    95    96    97    83    84    91  
   82    88    89    90    95  
   88    89    90    95  
   91    92    93    94    98    99   112    84    85    86    87  
   85    86    87    91    93  
   86    87  
   87  
    0  
   89    90    95    96    97  
   90    95    96    97  
   95    96    97  
   92    93    94    98  
   93  
   94    98    99   100   103   112   113   101  
   98    99   112  
   96    97  
   97  
    0  
   99   100   103   104   112   113   105   101   102   109  
  100   103   104   112   113   105   106   107   108   101   102   109   110   111  
  103   104   112   113   105   106   107   108   101   102   109  
  102   109   110   111   103   105   112  
  109   110   111  
  104   112   113   105   106   107   108  
  112   113   105  
  106   107   108   112  
  107   108  
  108  
    0  
  110   111  
  111  
    0  
  113  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760   0.051300   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
   43   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   44   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   45   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   46   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   47   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   48   3.5500   0.0700  -0.008000   2.0020   1.7750   0.001000000  -0.843144165
   49   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   52   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   53   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   55   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   60   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   61   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5500   0.0700  -0.163000   2.0020   1.7750   0.001000000  -0.843144165
   63   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.2500   0.1700  -0.239000   1.8650   1.6500   0.001000000  -0.511443539
   67   0.5000   0.0300   0.317000   0.9960   0.8600   0.030040813  -0.651083722
   68   3.5000   0.0660   0.190000   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   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   74   3.5500   0.0700  -0.163000   2.0020   1.7750   0.001000000  -0.843144165
   75   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   76   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   77   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   78   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   79   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   80   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   3.5500   0.0700  -0.008000   2.0020   1.7750   0.001000000  -0.843144165
   84   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   90   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   91   3.2500   0.1700  -0.239000   1.8650   1.6500   0.001000000  -0.511443539
   92   0.5000   0.0300   0.317000   0.9960   0.8600   0.030040813  -0.651083722
   93   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   94   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   95   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   96   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   97   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   98   3.5500   0.0760   0.051300   2.0020   1.7750   0.023028004  -0.852763146
   99   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
  100   3.5500   0.0760  -0.056700   2.0020   1.7750   0.023028004  -0.852763146
  101   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
  102   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  103   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
  104   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
  105   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
  110   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  111   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  112   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
  113   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    49   268.000  1.529
   33    38   268.000  1.529
   37    42   400.000  1.384
   37    44   549.000  1.340
   42    43   434.000  1.010
   42    46   490.000  1.335
   46    47   570.000  1.229
   46    49   317.000  1.522
   49    50   340.000  1.090
   49    52   317.000  1.510
   52    53   340.000  1.080
   52    59   549.000  1.340
   59    60   340.000  1.080
   59    61   340.000  1.080
   44    45   340.000  1.080
   44    48   375.000  1.423
   48    51   546.000  1.367
   48    66   427.000  1.381
   51    54   469.000  1.424
   51    55   285.000  1.502
   54    62   546.000  1.367
   54    63   285.000  1.502
   62    66   427.000  1.381
   62    68   295.000  1.489
   66    67   434.000  1.010
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    74   295.000  1.489
   74    78   546.000  1.367
   74    91   427.000  1.381
   78    79   469.000  1.424
   78    80   285.000  1.502
   79    83   546.000  1.367
   79    84   285.000  1.502
   83    91   427.000  1.381
   83    93   375.000  1.423
   91    92   434.000  1.010
   93    94   340.000  1.080
   93    98   549.000  1.340
   98    99   380.000  1.444
   98   112   400.000  1.384
   99   100   549.000  1.340
   99   101   380.000  1.444
  100   103   410.000  1.444
  100   105   317.000  1.510
  103   104   570.000  1.229
  103   112   490.000  1.335
  112   113   434.000  1.010
  105   106   340.000  1.090
  105   107   340.000  1.090
  105   108   340.000  1.090
  101   102   340.000  1.080
  101   109   549.000  1.340
  109   110   340.000  1.080
  109   111   340.000  1.080
   84    85   340.000  1.090
   84    86   340.000  1.090
   84    87   340.000  1.090
   80    81   340.000  1.090
   80    82   340.000  1.090
   80    88   268.000  1.529
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    95   317.000  1.522
   95    96   656.000  1.250
   95    97   656.000  1.250
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    71   268.000  1.529
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    75   317.000  1.522
   75    76   656.000  1.250
   75    77   656.000  1.250
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    49    75.00000  111.63000
   29    33    38    75.00000  111.63000
   33    37    42    70.00000  113.82800
   33    37    44    70.00000  124.00000
   33    49    46    63.00000  111.10000
   33    49    50    37.50000  110.70000
   33    49    52    70.00000  112.02700
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    37.50000  110.70000
   37    42    43    45.00000  117.55000
   37    42    46    70.00000  120.89900
   37    44    45    35.00000  120.00000
   37    44    48    55.00000  128.24000
   42    46    47    80.00000  122.90000
   42    46    49    70.00000  116.60000
   46    42    43    35.00000  119.80000
   46    49    50    35.00000  109.50000
   46    49    52    70.00000  115.00700
   49    33    37    70.00000  112.02700
   49    46    47    80.00000  120.40000
   49    52    53    35.00000  117.00000
   49    52    59    70.00000  124.00000
   52    49    50    35.00000  109.50000
   52    59    60    35.00000  120.00000
   52    59    61    35.00000  120.00000
   59    52    53    35.00000  120.00000
   61    59    60    35.00000  117.00000
   44    37    42    75.00000  120.83300
   44    48    51    50.00000  133.16000
   44    48    66    70.00000  120.38000
   48    44    45    40.00000  117.26300
   48    51    54    70.00000  107.30000
   48    51    55    60.00000  130.00000
   48    66    62    70.00000  109.80000
   48    66    67    35.00000  120.00000
   51    54    62    70.00000  107.30000
   51    54    63    60.00000  130.00000
   51    55    56    35.00000  109.50000
   51    55    57    35.00000  109.50000
   51    55    58    35.00000  109.50000
   54    62    66    70.00000  107.70000
   54    62    68    50.00000  133.50000
   54    63    64    35.00000  109.50000
   54    63    65    35.00000  109.50000
   54    63    71    70.00000  112.17500
   62    66    67    35.00000  120.00000
   62    68    69    45.00000  110.47400
   62    68    70    45.00000  110.47400
   62    68    74    70.00000  112.04700
   66    48    51    70.00000  107.70000
   68    62    66    65.00000  122.56900
   68    74    78    50.00000  133.50000
   68    74    91    65.00000  122.56900
   70    68    69    33.00000  107.80000
   74    68    69    45.00000  110.47400
   74    68    70    45.00000  110.47400
   74    78    79    70.00000  107.30000
   74    78    80    60.00000  130.00000
   74    91    83    70.00000  109.80000
   74    91    92    35.00000  120.00000
   78    79    83    70.00000  107.30000
   78    79    84    60.00000  130.00000
   78    80    81    35.00000  109.50000
   78    80    82    35.00000  109.50000
   78    80    88    70.00000  112.17500
   79    83    91    70.00000  107.70000
   79    83    93    50.00000  133.16000
   79    84    85    35.00000  109.50000
   79    84    86    35.00000  109.50000
   79    84    87    35.00000  109.50000
   83    91    92    35.00000  120.00000
   83    93    94    40.00000  117.26300
   83    93    98    55.00000  128.24000
   91    74    78    70.00000  107.70000
   93    83    91    70.00000  120.38000
   93    98    99    70.00000  123.01800
   93    98   112    75.00000  120.83300
   98    93    94    35.00000  120.00000
   98    99   100    70.00000  123.01800
   98    99   101    70.00000  123.01800
   98   112   103    70.00000  120.89900
   98   112   113    45.00000  117.55000
   99   100   103    70.00000  118.70000
   99   100   105    70.00000  124.00000
   99   101   102    35.00000  120.00000
   99   101   109    70.00000  123.01800
  100   103   104    80.00000  125.30000
  100   103   112    80.00000  111.56200
  100   105   106    35.00000  109.50000
  100   105   107    35.00000  109.50000
  100   105   108    35.00000  109.50000
  103   112   113    35.00000  119.80000
  112    98    99    75.00000  120.83300
  112   103   104    80.00000  122.90000
  105   100   103    70.00000  119.70000
  107   105   106    33.00000  107.80000
  108   105   106    33.00000  107.80000
  108   105   107    33.00000  107.80000
  101    99   100    70.00000  123.01800
  101   109   110    35.00000  120.00000
  101   109   111    35.00000  120.00000
  109   101   102    35.00000  120.00000
  111   109   110    35.00000  117.00000
   84    79    83    60.00000  130.00000
   86    84    85    33.00000  107.80000
   87    84    85    33.00000  107.80000
   87    84    86    33.00000  107.80000
   80    78    79    60.00000  130.00000
   80    88    89    37.50000  110.70000
   80    88    90    37.50000  110.70000
   80    88    95    70.00000  109.69300
   82    80    81    33.00000  107.80000
   88    80    81    37.50000  110.70000
   88    80    82    37.50000  110.70000
   88    95    96    70.00000  117.00000
   88    95    97    70.00000  117.00000
   90    88    89    33.00000  107.80000
   95    88    89    35.00000  109.50000
   95    88    90    35.00000  109.50000
   97    95    96    80.00000  126.00000
   63    54    62    60.00000  130.00000
   63    71    72    37.50000  110.70000
   63    71    73    37.50000  110.70000
   63    71    75    70.00000  109.69300
   65    63    64    33.00000  107.80000
   71    63    64    37.50000  110.70000
   71    63    65    37.50000  110.70000
   71    75    76    70.00000  117.00000
   71    75    77    70.00000  117.00000
   73    71    72    33.00000  107.80000
   75    71    72    35.00000  109.50000
   75    71    73    35.00000  109.50000
   77    75    76    80.00000  126.00000
   55    51    54    60.00000  130.00000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   38    33    37    70.00000  112.02700
   38    33    49    58.35000  112.70000
   40    38    39    33.00000  107.80000
   41    38    39    33.00000  107.80000
   41    38    40    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    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
   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
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    42   0.09700  1.0 1.0
   29    33    37    42   0.15600 -1.0 2.0
   29    33    37    42  -0.50800  1.0 3.0
   29    33    37    44   0.42700  1.0 1.0
   29    33    37    44  -0.70350 -1.0 2.0
   29    33    37    44  -0.43150  1.0 3.0
   29    33    49    46   0.56750  1.0 1.0
   29    33    49    46  -0.07550 -1.0 2.0
   29    33    49    46   0.20000  1.0 3.0
   29    33    49    50   0.15000  1.0 3.0
   29    33    49    52   0.56750  1.0 1.0
   29    33    49    52  -0.07550 -1.0 2.0
   29    33    49    52   0.20000  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.15000  1.0 3.0
   33    37    42    43   2.40850 -1.0 2.0
   33    37   -42    46  -0.45200  1.0 1.0
   33    37   -42    46   0.85900 -1.0 2.0
   33    37   -42    46   0.16650  1.0 3.0
   33    37    44    45   7.00000 -1.0 2.0
   33    37    44    48   7.00000 -1.0 2.0
   33    49    52    53   0.00000  1.0 1.0
   33    49    52    59   0.09850  1.0 1.0
   33    49    52    59   0.15250 -1.0 2.0
   33    49    52    59  -0.50650  1.0 3.0
   37    33   -49    46  -0.98800  1.0 1.0
   37    33   -49    46   0.48800 -1.0 2.0
   37    33   -49    46   0.76800  1.0 3.0
   37    33    49    50   0.15000  1.0 3.0
   37    33    49    52   0.31000  1.0 1.0
   37    33    49    52   0.14700 -1.0 2.0
   37    33    49    52   0.07550  1.0 3.0
   37    33    38    39   0.15000  1.0 3.0
   37    33    38    40   0.15000  1.0 3.0
   37    33    38    41   0.15000  1.0 3.0
   37    42    46    47   2.67200 -1.0 2.0
   37    42   -46    49   0.67100  1.0 1.0
   37    42   -46    49   1.42150 -1.0 2.0
   37    42   -46    49   0.18700  1.0 3.0
   37    44    48    51   0.15800  1.0 1.0
   37    44    48    51   1.85350 -1.0 2.0
   37    44    48    51  -0.48700  1.0 3.0
   37    44    48    66   0.11450  1.0 1.0
   37    44    48    66   1.85100 -1.0 2.0
   37    44    48    66  -0.49050  1.0 3.0
   42    37    44    45   7.00000 -1.0 2.0
   42    37    44    48   7.00000 -1.0 2.0
   42    46   -49    33   1.39750  1.0 1.0
   42    46   -49    33  -0.07950 -1.0 2.0
   42    46   -49    33  -0.18750  1.0 3.0
   42    46    49    50   0.00000  1.0 1.0
   42    46    49    52   0.00000  1.0 1.0
   43    42    46    47   2.45000 -1.0 2.0
   43    42    46    49   2.45000 -1.0 2.0
   46    49    52    53   0.00000  1.0 1.0
   46    49    52    59  -0.51250  1.0 1.0
   46    49    52    59  -0.88800 -1.0 2.0
   46    49    52    59   0.08850  1.0 3.0
   47    46    49    33   0.30150 -1.0 2.0
   47    46    49    50   0.00000  1.0 1.0
   47    46    49    52   0.30150 -1.0 2.0
   49    33   -37    42  -0.93550  1.0 1.0
   49    33   -37    42   0.38900 -1.0 2.0
   49    33   -37    42   0.16950  1.0 3.0
   49    33    37    44   0.09850  1.0 1.0
   49    33    37    44   0.15250 -1.0 2.0
   49    33    37    44  -0.50650  1.0 3.0
   49    33    38    39   0.15000  1.0 3.0
   49    33    38    40   0.15000  1.0 3.0
   49    33    38    41   0.15000  1.0 3.0
   49    52    59    60   7.00000 -1.0 2.0
   49    52    59    61   7.00000 -1.0 2.0
   50    49    52    53   0.33100  1.0 3.0
   50    49    52    59   0.00000  1.0 1.0
   53    52    59    60   7.00000 -1.0 2.0
   53    52    59    61   7.00000 -1.0 2.0
   44    37    42    43   0.78350 -1.0 2.0
   44    37    42    46  -0.18900  1.0 1.0
   44    37    42    46   1.70900 -1.0 2.0
   44    48    51    54   3.62500 -1.0 2.0
   44    48    51    55   3.62500 -1.0 2.0
   44    48    66    62   3.62500 -1.0 2.0
   44    48    66    67   2.00000 -1.0 2.0
   45    44    48    51   0.56550  1.0 3.0
   45    44    48    66   0.54250  1.0 3.0
   48    51   -54    62   3.62500 -1.0 2.0
   48    51    54    63   3.62500 -1.0 2.0
   48    51    55    56   0.00000  1.0 1.0
   48    51    55    57   0.00000  1.0 1.0
   48    51    55    58   0.00000  1.0 1.0
   51    48   -66    62   3.62500 -1.0 2.0
   51    48    66    67   2.00000 -1.0 2.0
   51    54   -62    66   3.62500 -1.0 2.0
   51    54    62    68   3.62500 -1.0 2.0
   51    54    63    64   0.00000  1.0 1.0
   51    54    63    65   0.00000  1.0 1.0
   51    54    63    71   0.04150 -1.0 2.0
   54    51    55    56   0.00000  1.0 1.0
   54    51    55    57   0.00000  1.0 1.0
   54    51    55    58   0.00000  1.0 1.0
   54    62   -66    48   3.62500 -1.0 2.0
   54    62    66    67   2.00000 -1.0 2.0
   54    62    68    69   0.00000  1.0 1.0
   54    62    68    70   0.00000  1.0 1.0
   54    62    68    74   0.04300 -1.0 2.0
   54    63    71    72   0.43200  1.0 3.0
   54    63    71    73   0.43200  1.0 3.0
   54    63    71    75  -2.95950  1.0 1.0
   54    63    71    75   0.02300  1.0 3.0
   62    54    63    64   0.00000  1.0 1.0
   62    54    63    65   0.00000  1.0 1.0
   62    54    63    71   0.04150 -1.0 2.0
   62    68    74    78   0.04300 -1.0 2.0
   62    68    74    91   0.04300 -1.0 2.0
   66    48   -51    54   3.62500 -1.0 2.0
   66    48    51    55   3.62500 -1.0 2.0
   66    62    68    69   0.00000  1.0 1.0
   66    62    68    70   0.00000  1.0 1.0
   66    62    68    74   0.04300 -1.0 2.0
   68    62    66    48   3.62500 -1.0 2.0
   68    62    66    67   2.00000 -1.0 2.0
   68    74    78    79   3.62500 -1.0 2.0
   68    74    78    80   3.62500 -1.0 2.0
   68    74    91    83   3.62500 -1.0 2.0
   68    74    91    92   2.00000 -1.0 2.0
   69    68    74    78   0.00000  1.0 1.0
   69    68    74    91   0.00000  1.0 1.0
   70    68    74    78   0.00000  1.0 1.0
   70    68    74    91   0.00000  1.0 1.0
   74    78   -79    83   3.62500 -1.0 2.0
   74    78    79    84   3.62500 -1.0 2.0
   74    78    80    81   0.00000  1.0 1.0
   74    78    80    82   0.00000  1.0 1.0
   74    78    80    88   0.04150 -1.0 2.0
   78    74   -91    83   3.62500 -1.0 2.0
   78    74    91    92   2.00000 -1.0 2.0
   78    79   -83    91   3.62500 -1.0 2.0
   78    79    83    93   3.62500 -1.0 2.0
   78    79    84    85   0.00000  1.0 1.0
   78    79    84    86   0.00000  1.0 1.0
   78    79    84    87   0.00000  1.0 1.0
   78    80    88    89   0.43200  1.0 3.0
   78    80    88    90   0.43200  1.0 3.0
   78    80    88    95  -2.95950  1.0 1.0
   78    80    88    95   0.02300  1.0 3.0
   79    78    80    81   0.00000  1.0 1.0
   79    78    80    82   0.00000  1.0 1.0
   79    78    80    88   0.04150 -1.0 2.0
   79    83   -91    74   3.62500 -1.0 2.0
   79    83    91    92   2.00000 -1.0 2.0
   79    83    93    94   0.56550  1.0 3.0
   79    83    93    98   0.15800  1.0 1.0
   79    83    93    98   1.85350 -1.0 2.0
   79    83    93    98  -0.48700  1.0 3.0
   83    79    84    85   0.00000  1.0 1.0
   83    79    84    86   0.00000  1.0 1.0
   83    79    84    87   0.00000  1.0 1.0
   83    93    98    99   7.00000 -1.0 2.0
   83    93    98   112   7.00000 -1.0 2.0
   91    74   -78    79   3.62500 -1.0 2.0
   91    74    78    80   3.62500 -1.0 2.0
   91    83    93    94   0.54250  1.0 3.0
   91    83    93    98   0.11450  1.0 1.0
   91    83    93    98   1.85100 -1.0 2.0
   91    83    93    98  -0.49050  1.0 3.0
   93    83    91    74   3.62500 -1.0 2.0
   93    83    91    92   2.00000 -1.0 2.0
   93    98    99   100   0.28850  1.0 1.0
   93    98    99   100   2.61350 -1.0 2.0
   93    98    99   100   0.78400  1.0 3.0
   93    98    99   101   0.28850  1.0 1.0
   93    98    99   101   2.61350 -1.0 2.0
   93    98    99   101   0.78400  1.0 3.0
   93    98   112   103  -0.18900  1.0 1.0
   93    98   112   103   1.70900 -1.0 2.0
   93    98   112   113   0.78350 -1.0 2.0
   94    93    98    99   7.00000 -1.0 2.0
   94    93    98   112   7.00000 -1.0 2.0
   98    99  -100   103   7.00000 -1.0 2.0
   98    99   100   105   7.00000 -1.0 2.0
   98    99   101   102  -0.18600  1.0 3.0
   98    99   101   109   0.28850  1.0 1.0
   98    99   101   109   2.61350 -1.0 2.0
   98    99   101   109   0.78400  1.0 3.0
   99    98  -112   103  -0.18900  1.0 1.0
   99    98  -112   103   1.70900 -1.0 2.0
   99    98   112   113   0.78350 -1.0 2.0
   99   100   103   104   1.00000 -1.0 2.0
   99   100  -103   112   0.49500  1.0 1.0
   99   100  -103   112   1.31600 -1.0 2.0
   99   100  -103   112  -0.02300  1.0 3.0
   99   100   105   106   0.00000  1.0 1.0
   99   100   105   107   0.00000  1.0 1.0
   99   100   105   108   0.00000  1.0 1.0
   99   101   109   110   7.00000 -1.0 2.0
   99   101   109   111   7.00000 -1.0 2.0
  100    99   101   102  -0.18600  1.0 3.0
  100    99   101   109   0.28850  1.0 1.0
  100    99   101   109   2.61350 -1.0 2.0
  100    99   101   109   0.78400  1.0 3.0
  100   103  -112    98   2.45000 -1.0 2.0
  100   103   112   113   2.56700 -1.0 2.0
  103   100   105   106   0.15000  1.0 3.0
  103   100   105   107   0.15000  1.0 3.0
  103   100   105   108   0.15000  1.0 3.0
  104   103   112    98   2.67200 -1.0 2.0
  104   103   112   113   2.45000 -1.0 2.0
  112    98   -99   100  -0.18600  1.0 3.0
  112    98    99   101  -0.18600  1.0 3.0
  105   100   103   104  -0.64400  1.0 1.0
  105   100   103   104   0.26850 -1.0 2.0
  105   100   103   112   1.59650  1.0 1.0
  105   100   103   112   0.42750 -1.0 2.0
  105   100   103   112  -0.48350  1.0 3.0
  101    99   100   103   7.00000 -1.0 2.0
  101    99   100   105   7.00000 -1.0 2.0
  102   101   109   110   7.00000 -1.0 2.0
  102   101   109   111   7.00000 -1.0 2.0
   84    79    83    91   3.62500 -1.0 2.0
   84    79    83    93   3.62500 -1.0 2.0
   80    78    79    83   3.62500 -1.0 2.0
   80    78    79    84   3.62500 -1.0 2.0
   80    88    95    96   0.41150 -1.0 2.0
   80    88    95    97   0.41150 -1.0 2.0
   81    80    88    89   0.15000  1.0 3.0
   81    80    88    90   0.15000  1.0 3.0
   81    80    88    95  -0.11250  1.0 3.0
   82    80    88    89   0.15000  1.0 3.0
   82    80    88    90   0.15000  1.0 3.0
   82    80    88    95  -0.11250  1.0 3.0
   89    88    95    96   0.00000  1.0 1.0
   89    88    95    97   0.00000  1.0 1.0
   90    88    95    96   0.00000  1.0 1.0
   90    88    95    97   0.00000  1.0 1.0
   63    54    62    66   3.62500 -1.0 2.0
   63    54    62    68   3.62500 -1.0 2.0
   63    71    75    76   0.41150 -1.0 2.0
   63    71    75    77   0.41150 -1.0 2.0
   64    63    71    72   0.15000  1.0 3.0
   64    63    71    73   0.15000  1.0 3.0
   64    63    71    75  -0.11250  1.0 3.0
   65    63    71    72   0.15000  1.0 3.0
   65    63    71    73   0.15000  1.0 3.0
   65    63    71    75  -0.11250  1.0 3.0
   72    71    75    76   0.00000  1.0 1.0
   72    71    75    77   0.00000  1.0 1.0
   73    71    75    76   0.00000  1.0 1.0
   73    71    75    77   0.00000  1.0 1.0
   55    51    54    62   3.62500 -1.0 2.0
   55    51    54    63   3.62500 -1.0 2.0
   38    33    37    42  -0.93550  1.0 1.0
   38    33    37    42   0.38900 -1.0 2.0
   38    33    37    42   0.16950  1.0 3.0
   38    33    37    44   0.09850  1.0 1.0
   38    33    37    44   0.15250 -1.0 2.0
   38    33    37    44  -0.50650  1.0 3.0
   38    33    49    46  -0.95700  1.0 1.0
   38    33    49    46  -0.18200 -1.0 2.0
   38    33    49    46   0.29450  1.0 3.0
   38    33    49    50   0.15000  1.0 3.0
   38    33    49    52   0.34400  1.0 1.0
   38    33    49    52   0.09450 -1.0 2.0
   38    33    49    52   0.11100  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
   35    30    34    36  10.50000 -1.0 2.0
   33    42    37    44   1.10000 -1.0 2.0
   43    46    42    37   1.00000 -1.0 2.0
   42    49    46    47  10.50000 -1.0 2.0
   49    53    52    59  15.00000 -1.0 2.0
   60    61    59    52  15.00000 -1.0 2.0
   48    45    44    37   1.10000 -1.0 2.0
   51    66    48    44   4.00000 -1.0 2.0
   54    55    51    48   4.00000 -1.0 2.0
   62    63    54    51   4.00000 -1.0 2.0
   68    66    62    54   4.00000 -1.0 2.0
   67    48    66    62   1.00000 -1.0 2.0
   78    91    74    68   4.00000 -1.0 2.0
   79    80    78    74   4.00000 -1.0 2.0
   83    84    79    78   4.00000 -1.0 2.0
   93    91    83    79   4.00000 -1.0 2.0
   92    74    91    83   1.00000 -1.0 2.0
   83    94    93    98   1.10000 -1.0 2.0
   99   112    98    93   1.10000 -1.0 2.0
   98   101    99   100   1.10000 -1.0 2.0
  103   105   100    99   1.10000 -1.0 2.0
  100   112   103   104  10.50000 -1.0 2.0
  113   103   112    98   1.00000 -1.0 2.0
   99   102   101   109  15.00000 -1.0 2.0
  110   111   109   101  15.00000 -1.0 2.0
   96    88    95    97  10.50000 -1.0 2.0
   76    71    75    77  10.50000 -1.0 2.0
END
