* LIGAND DATABASE FILE (OPLS2005)
*
001     109   111    200    306     586
    1     0 S   NP   _N1_     1    29.75844    98.83077   -17.93292
    2     1 S   H    _HN1     2     1.02936    59.84325    25.60119
    3     1 S   H    _H1_     3     1.02836    65.63359   154.73161
    4     1 S   H    _H2_     4     1.02786    81.93873   -91.33537
    5     1 S   CT   _CA1     5     1.50218   165.40434    76.67368
    6     5 S   HC   _HA1     6     1.09567   105.00010   131.77549
    7     5 S   CO3  _C1_     7     1.53858   112.87828    12.12174
    8     7 S   O2Z  _O11     8     1.26369   114.94742   -26.56131
    9     7 S   O2Z  _O12     9     1.26287   115.22940   152.80032
   10     5 S   CT   _CB1    10     1.53186   107.35408  -110.11493
   11    10 S   HC   HB11    11     1.09829   109.38753   -45.60708
   12    10 S   HC   HB12    12     1.09813   110.40397    71.11018
   13    10 S   CT   _CG1    13     1.52960   112.65119  -166.48634
   14    13 S   HC   HG11    14     1.09501   110.66066   -70.80586
   15    13 S   HC   HG12    15     1.09677   109.61655    48.28766
   16    13 S   C    _CD1    16     1.51858   112.32247   168.91418
   17    16 S   O    _OE1    17     1.22700   123.21859    16.68863
   18    16 S   N    _N2_    18     1.38615   111.57530  -163.99534
   19    18 S   H    _HN2    19     1.01582   118.77963     0.88470
   20    18 S   CT1  _CA2    20     1.46102   123.82023   175.60707
   21    20 S   HC   _HA2    21     1.09742   109.38843    -3.59543
   22    20 S   C    _C2_    22     1.53591   107.78121  -118.52200
   23    22 S   O    _O2_    23     1.23010   122.50207  -146.77000
   24    20 S   CT   _CB2    32     1.53317   111.82577   119.01773
   25    24 S   HC   HB21    33     1.09528   111.10546    52.69653
   26    24 S   HC   HB22    34     1.09541   110.08428   170.72210
   27    22 S   N    _N3_    24     1.38393   113.40951    40.60503
   28    27 S   H    _HN3    25     1.01603   119.47814    -3.18032
   29    24 S   S    _SG2    35     1.82769   111.82250   -71.76578
   30    27 S   CT   _CA3    26     1.45271   123.34496   177.30979
   31    30 S   HC   HA31    27     1.09542   107.49886   -65.30494
   32    30 S   HC   HA32    28     1.09550   108.02759    51.17703
   33    29 S   CT   _C24    36     1.82281   100.92590   117.52239
   34    33 S   HC   _H5_    37     1.09817   107.59244    53.28705
   35    30 S   CO3  _C3_    29     1.52980   113.97125   173.16781
   36    35 S   O2Z  _O31    30     1.26394   116.04059    -0.95388
   37    35 S   O2Z  _O32    31     1.26417   114.43520   179.11177
   38    33 S   CT   _C23    38     1.52850   113.48187   -67.23837
   39    38 S   HC   _H26    39     1.09338   113.62396    74.89733
   40    38 S   HC   _H27    40     1.09630   111.09050   -47.71850
   41    38 S   CP1  _C22    41     1.52157   103.03662  -164.74064
   42    41 S   HC   _H24    42     1.09182   111.21196   148.61633
   43    41 S   HC   _H25    43     1.09530   111.64893   -88.92827
   44    41 S   N    _N6_    44     1.46183   105.14563    28.29584
   45    44 S   C    _C21    45     1.39522   126.81183  -176.29567
   46    45 S   O    _O36    46     1.23007   122.78842   170.53552
   47    33 S   CT1  _C25    87     1.54397   116.23397   174.17516
   48    47 S   HC   _H6_    88     1.09619   111.87215   -84.29901
   49    45 S   C5B  _C19    47     1.44898   117.24587    -7.17004
   50    49 S   C5A  _C20    48     1.37583   128.55036   -53.84175
   51    50 S   HA   _H23    49     1.07953   135.48778    -0.34605
   52    50 S   OA   _O35    50     1.35960   108.24356   179.03146
   53    52 S   CRA  _C18    51     1.36743   104.04150     1.96084
   54    53 S   CT   _C17    52     1.47938   116.54350  -177.26362
   55    54 S   HC   _H21    53     1.09458   108.61697    58.62538
   56    54 S   HC   _H22    54     1.09422   111.30531   177.47354
   57    49 S   N5B  _N5_   109     1.37925   122.12523   128.53961
   58    54 S   CO4  _C16    55     1.51446   110.56535   -62.17124
   59    58 S   O    _O34    56     1.23191   122.17510   -41.93150
   60    58 S   CT   _C15    57     1.51867   116.95956   140.13568
   61    60 S   HC   _H19    58     1.09646   110.35719    -2.02197
   62    60 S   HC   _H20    59     1.09673   107.83196   112.60881
   63    60 S   CT   _C14    60     1.52952   112.09008  -125.40771
   64    63 S   HC   _H4_    61     1.09204   110.24029   -61.56597
   65    63 S   CM   _C13    62     1.50623   111.65364    64.02745
   66    65 S   HC   _H18    63     1.09082   113.59796    68.58842
   67    63 S   OH   _O39   107     1.42865   108.59027  -177.97059
   68    67 S   HO   _H35   108     0.97249   107.49047    62.30228
   69    65 S   CM   _C12    64     1.35010   128.07446  -110.04381
   70    69 S   CM   _C11    65     1.46535   118.68644   177.69412
   71    70 S   HC   _H17    66     1.08909   116.11604     1.19305
   72    69 S   CT   _C31   103     1.50784   123.89833    -0.40926
   73    72 S   HC   _H36   104     1.09570   110.46870  -120.54900
   74    72 S   HC   _H37   105     1.09590   110.55019   118.99525
   75    72 S   HC   _H38   106     1.09123   113.87099    -0.63304
   76    70 S   CM   _C10    67     1.34296   126.16052  -177.34156
   77    76 S   HC   _H16    68     1.08686   120.38016    -1.70789
   78    76 S   CT   _C9_    69     1.49853   124.34534   178.46405
   79    78 S   HC   _H14    70     1.09443   112.35644     4.73040
   80    78 S   HC   _H15    71     1.09489   109.94263   125.91487
   81    78 S   N    _N4_    72     1.45124   108.99070  -114.45925
   82    81 S   H    _H13    73     1.01543   117.55116   105.40396
   83    81 S   C    _C8_    74     1.38338   122.51470   -77.01660
   84    83 S   O    _O33    75     1.22697   125.19639     0.15195
   85    83 S   CM   _C7_    76     1.48779   112.27521   179.00535
   86    85 S   HC   _H12    77     1.08365   119.05000     7.40398
   87    85 S   CM   _C6_    78     1.34026   119.52039  -172.43167
   88    87 S   HC   _H11    79     1.08840   119.62469    -0.01978
   89    87 S   CT   _C5_    80     1.50824   124.12860  -179.62727
   90    89 S   HC   _H3_    81     1.09969   108.18791    13.10598
   91    89 S   CT   _C27    82     1.55636   114.38342  -106.34284
   92    91 S   HC   _H7_    83     1.09812   105.40201  -167.34943
   93    89 S   CT   _C4_    99     1.53337   108.84304   128.67450
   94    93 S   HC   _H8_   100     1.09515   112.00934    63.68748
   95    93 S   HC   _H9_   101     1.09620   110.87467   -56.72354
   96    93 S   HC   _H10   102     1.09538   110.70551  -175.81905
   97    91 S   OS   _O38    84     1.44971   106.87184    76.94866
   98    91 S   CT   _C28    89     1.55409   116.48009   -46.97587
   99    98 S   HC   _H28    90     1.09637   108.98786   -33.29027
  100    97 S   CO4  _C26    85     1.36229   118.25137   131.45344
  101   100 S   O    _O37    86     1.22659   125.18347     4.62792
  102    98 S   CT   _C29    91     1.53422   114.28916    88.43830
  103   102 S   HC   _H29    92     1.09510   111.60526    64.97396
  104   102 S   HC   _H30    93     1.09157   112.45520   -56.40428
  105   102 S   HC   _H31    94     1.09584   110.24362  -175.90983
  106    98 S   CT   _C30    95     1.53578   110.32467  -149.71063
  107   106 S   HC   _H32    96     1.09455   111.66407   -64.72935
  108   106 S   HC   _H33    97     1.09556   110.61593   175.30268
  109   106 S   HC   _H34    98     1.09509   110.92660    56.15183
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  14   8   2   1   1  10   6   5   9   4   3  10  10   4   6   3
   6   5   3   6   7   9   5   4   1   8   4   9   5   4   8   5
  11   4   2   1   9  11   4   4   2   1   1   7   4   7   4   3
   6   3   6   3   7   3  11   4  13   8  18   7   5   2   1   1
   6  10   8   1   1   7   3   2   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    47    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    44   100    47    48  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    44    45    97   100   101    47    48  
   38    39    40    41    44   100    47    48  
   36    37  
   37  
    0  
   39    40    41    42    43    44    45   100    47    48  
   40    41    42    43    44    47  
   41    42    43    44    47  
   42    43    44    45    46    49   100    47    48  
   43    44    45    47  
   44    45    47  
   45    46    49    50    97   100   101    47    48    57  
   46    49    50    51    52    53   100    47    48    57  
   49    50    47    57  
   48    49    91    97   100   101  
   97   100   101  
   50    51    52    53    54    57  
   51    52    53    54    57  
   52    53    57  
   53    54    55    56    58    57  
   54    55    56    58    59    60    57  
   55    56    58    59    60    61    62    63    57  
   56    58    59    60    57  
   58    59    60    57  
   58  
   59    60    61    62    63    64    65    67  
   60    61    62    63  
   61    62    63    64    65    66    69    67    68  
   62    63    64    65    67  
   63    64    65    67  
   64    65    66    69    70    72    67    68  
   65    66    69    67    68  
   66    69    70    71    76    72    73    74    75    67    68  
   69    70    72    67  
   68    69  
    0  
   70    71    76    77    78    72    73    74    75  
   71    76    77    78    79    80    81    72    73    74    75  
   76    77    78    72  
   73    74    75    76  
   74    75  
   75  
    0  
   77    78    79    80    81    82    83  
   78    79    80    81  
   79    80    81    82    83    84    85  
   80    81    82    83  
   81    82    83  
   82    83    84    85    86    87  
   83    84    85  
   84    85    86    87    88    89  
   85    86    87  
   86    87    88    89    90    91    93  
   87    88    89  
   88    89    90    91    92    97    98    93    94    95    96  
   89    90    91    93  
   90    91    92    97   100    98    99   102   106    93    94    95    96  
   91    92    97    98    93    94    95    96  
   92    97   100   101    98    99   102   103   104   105   106   107   108   109    93    94    95    96  
   97   100    98    99   102   106    93  
   94    95    96    97    98  
   95    96  
   96  
    0  
  100   101    98    99   102   106  
   99   102   103   104   105   106   107   108   109   100  
  102   103   104   105   106   107   108   109  
  101  
    0  
  103   104   105   106   107   108   109  
  104   105   106  
  105   106  
  106  
  107   108   109  
  108   109  
  109  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5000   0.0660  -0.120000   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   3.5000   0.0660  -0.050000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   43   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   44   3.2500   0.1700  -0.140000   1.8100   1.6000   0.054801302  -1.445846770
   45   3.7500   0.1050   0.615000   1.9250   1.7000   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   47   3.5000   0.0660   0.010000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   49   3.5500   0.0700   0.145000   2.5000   1.7750   0.001000000  -0.843144165
   50   3.5500   0.0700  -0.148000   2.0020   1.7750   0.001000000  -0.843144165
   51   2.4200   0.0300   0.181000   1.3810   1.2100   0.030040813   0.268726247
   52   2.9000   0.1400  -0.257000   1.6450   1.4500   0.001000000  -0.126889456
   53   3.5500   0.0700   0.439000   2.5000   1.7750   0.001000000  -0.843144165
   54   3.5000   0.0660  -0.005000   2.4950   1.7500   0.005000000  -0.741685710
   55   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   56   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   57   3.2500   0.1700  -0.590000   1.8650   1.6500   0.001000000  -0.511443539
   58   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   59   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   60   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   66   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   67   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   68   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   69   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   70   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   71   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   77   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   78   3.5000   0.0660   0.080000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   80   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   81   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   82   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   83   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   84   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   85   3.5500   0.0760  -0.171700   2.0020   1.7750   0.023028004  -0.852763146
   86   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   87   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   88   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   89   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   93   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   98   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
  101   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
  102   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   268.000  1.529
   33    47   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   268.000  1.529
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    44   337.000  1.449
   44    45   490.000  1.335
   44    47   337.000  1.449
   45    46   570.000  1.229
   45    49   310.000  1.477
   49    50   520.000  1.370
   49    57   410.000  1.394
   50    51   367.000  1.080
   50    52   340.000  1.360
   52    53   462.000  1.357
   53    54   295.000  1.488
   53    57   488.000  1.335
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    58   317.000  1.522
   58    59   570.000  1.229
   58    60   317.000  1.522
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   268.000  1.529
   63    64   340.000  1.090
   63    65   317.000  1.510
   63    67   320.000  1.410
   65    66   340.000  1.080
   65    69   549.000  1.340
   69    70   380.000  1.444
   69    72   317.000  1.510
   70    71   340.000  1.080
   70    76   549.000  1.340
   76    77   340.000  1.080
   76    78   317.000  1.510
   78    79   340.000  1.090
   78    80   340.000  1.090
   78    81   337.000  1.449
   81    82   434.000  1.010
   81    83   490.000  1.335
   83    84   570.000  1.229
   83    85   410.000  1.444
   85    86   340.000  1.080
   85    87   549.000  1.340
   87    88   340.000  1.080
   87    89   317.000  1.510
   89    90   340.000  1.090
   89    91   268.000  1.529
   89    93   268.000  1.529
   91    92   340.000  1.090
   91    97   320.000  1.410
   91    98   268.000  1.529
   97   100   214.000  1.327
  100   101   570.000  1.229
  100    47   255.000  1.522
   47    48   340.000  1.090
   98    99   340.000  1.090
   98   102   268.000  1.529
   98   106   268.000  1.529
  102   103   340.000  1.090
  102   104   340.000  1.090
  102   105   340.000  1.090
  106   107   340.000  1.090
  106   108   340.000  1.090
  106   109   340.000  1.090
   93    94   340.000  1.090
   93    95   340.000  1.090
   93    96   340.000  1.090
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    75   340.000  1.090
   67    68   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    47    75.00000  108.68000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    58.35000  112.70000
   33    47    44    80.00000  109.70000
   33    47   100    70.00000  110.61500
   33    47    48    37.50000  110.70000
   38    33    34    37.50000  110.70000
   38    41    42    37.50000  110.70000
   38    41    43    37.50000  110.70000
   38    41    44    80.00000  109.70000
   40    38    39    33.00000  107.80000
   41    38    39    37.50000  110.70000
   41    38    40    37.50000  110.70000
   41    44    45    50.00000  121.90000
   41    44    47    50.00000  118.00000
   43    41    42    33.00000  107.80000
   44    41    42    35.00000  109.50000
   44    41    43    35.00000  109.50000
   44    45    46    80.00000  122.90000
   44    45    49    75.00000  113.48100
   44    47   100    80.00000  110.29000
   44    47    48    35.00000  109.50000
   45    49    50    60.00000  124.35000
   45    49    57    65.00000  122.69000
   49    45    46    80.00000  122.33200
   49    50    51    35.00000  130.70000
   49    50    52    70.00000  108.00000
   49    57    53    70.00000  110.00000
   50    52    53    70.00000  104.00000
   52    50    51    35.00000  113.40000
   52    53    54    80.00000  117.62500
   52    53    57    70.00000  115.00000
   53    54    55    45.00000  109.19200
   53    54    56    45.00000  109.19200
   53    54    58    75.00000  105.85400
   54    58    59    80.00000  120.40000
   54    58    60    70.00000  116.00000
   56    54    55    33.00000  107.80000
   58    54    55    35.00000  109.50000
   58    54    56    35.00000  109.50000
   58    60    61    35.00000  109.50000
   58    60    62    35.00000  109.50000
   58    60    63    63.00000  111.10000
   60    58    59    80.00000  120.40000
   60    63    64    37.50000  110.70000
   60    63    65    70.00000  112.02700
   60    63    67    50.00000  109.50000
   62    60    61    33.00000  107.80000
   63    60    61    37.50000  110.70000
   63    60    62    37.50000  110.70000
   63    65    66    35.00000  117.00000
   63    65    69    70.00000  124.00000
   63    67    68    55.00000  108.50000
   65    63    64    35.00000  109.50000
   65    69    70    70.00000  123.01800
   65    69    72    70.00000  124.00000
   69    65    66    35.00000  120.00000
   69    70    71    35.00000  120.00000
   69    70    76    70.00000  123.01800
   69    72    73    35.00000  109.50000
   69    72    74    35.00000  109.50000
   69    72    75    35.00000  109.50000
   70    76    77    35.00000  120.00000
   70    76    78    70.00000  124.00000
   76    70    71    35.00000  120.00000
   76    78    79    35.00000  109.50000
   76    78    80    35.00000  109.50000
   76    78    81    75.00000  110.78400
   78    76    77    35.00000  117.00000
   78    81    82    38.00000  118.40000
   78    81    83    50.00000  121.90000
   80    78    79    33.00000  107.80000
   81    78    79    35.00000  109.50000
   81    78    80    35.00000  109.50000
   81    83    84    80.00000  122.90000
   81    83    85    80.00000  111.56200
   83    81    82    35.00000  119.80000
   83    85    86    35.00000  119.70000
   83    85    87    70.00000  118.70000
   85    83    84    80.00000  125.30000
   85    87    88    35.00000  120.00000
   85    87    89    70.00000  124.00000
   87    85    86    35.00000  120.00000
   87    89    90    35.00000  109.50000
   87    89    91    70.00000  112.02700
   87    89    93    70.00000  112.02700
   89    87    88    35.00000  117.00000
   89    91    92    37.50000  110.70000
   89    91    97    50.00000  109.50000
   89    91    98    58.35000  112.70000
   89    93    94    37.50000  110.70000
   89    93    95    37.50000  110.70000
   89    93    96    37.50000  110.70000
   91    89    90    37.50000  110.70000
   91    97   100    83.00000  116.90000
   91    98    99    37.50000  110.70000
   91    98   102    58.35000  112.70000
   91    98   106    58.35000  112.70000
   97    91    92    35.00000  109.50000
   97   100   101    83.00000  123.40000
   97   100    47    90.00000  109.72300
  100    47    48    45.00000  110.09800
   47    33    34    37.50000  110.70000
   47    33    38    58.35000  112.70000
   47    44    45    50.00000  121.90000
   47   100   101    75.00000  123.42600
   98    91    92    37.50000  110.70000
   98    91    97    50.00000  109.50000
   98   102   103    37.50000  110.70000
   98   102   104    37.50000  110.70000
   98   102   105    37.50000  110.70000
   98   106   107    37.50000  110.70000
   98   106   108    37.50000  110.70000
   98   106   109    37.50000  110.70000
  102    98    99    37.50000  110.70000
  104   102   103    33.00000  107.80000
  105   102   103    33.00000  107.80000
  105   102   104    33.00000  107.80000
  106    98    99    37.50000  110.70000
  106    98   102    58.35000  112.70000
  108   106   107    33.00000  107.80000
  109   106   107    33.00000  107.80000
  109   106   108    33.00000  107.80000
   93    89    90    37.50000  110.70000
   93    89    91    58.35000  112.70000
   95    93    94    33.00000  107.80000
   96    93    94    33.00000  107.80000
   96    93    95    33.00000  107.80000
   72    69    70    70.00000  124.00000
   74    72    73    33.00000  107.80000
   75    72    73    33.00000  107.80000
   75    72    74    33.00000  107.80000
   67    63    64    35.00000  109.50000
   67    63    65    90.00000  110.39200
   57    49    50    70.00000  111.00000
   57    53    54    65.00000  125.57700
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    47   0.01700  1.0 1.0
   24    29    33    47  -0.23550 -1.0 2.0
   24    29    33    47   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.44750  1.0 1.0
   29    33    38    41  -0.17800 -1.0 2.0
   29    33    38    41   0.20200  1.0 3.0
   29    33    47    44   0.71400  1.0 1.0
   29    33    47    44   0.04300 -1.0 2.0
   29    33    47    44   0.01450  1.0 3.0
   29    33    47   100  -2.17200  1.0 1.0
   29    33    47   100  -0.85700 -1.0 2.0
   29    33    47    48   0.15000  1.0 3.0
   33    38    41    42   0.15000  1.0 3.0
   33    38    41    43   0.15000  1.0 3.0
   33    38   -41    44   0.42250  1.0 1.0
   33    38   -41    44  -0.48100 -1.0 2.0
   33    38   -41    44   0.35650  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    41   0.15000  1.0 3.0
   34    33    47    44   0.23200  1.0 3.0
   34    33    47   100  -0.03800  1.0 3.0
   34    33    47    48   0.15000  1.0 3.0
   38    33   -47    44   0.42250  1.0 1.0
   38    33   -47    44  -0.48100 -1.0 2.0
   38    33   -47    44   0.35650  1.0 3.0
   38    33    47   100  -0.84850  1.0 1.0
   38    33    47   100  -0.22800 -1.0 2.0
   38    33    47   100   0.29250  1.0 3.0
   38    33    47    48   0.15000  1.0 3.0
   38    41    44    45   0.25950  1.0 1.0
   38    41    44    45   0.43850 -1.0 2.0
   38    41    44    45   2.61650  1.0 3.0
   38    41   -44    47   1.42950  1.0 1.0
   38    41   -44    47   1.02900 -1.0 2.0
   38    41   -44    47  -5.63300  1.0 3.0
   39    38    41    42   0.15000  1.0 3.0
   39    38    41    43   0.15000  1.0 3.0
   39    38    41    44   0.23200  1.0 3.0
   40    38    41    42   0.15000  1.0 3.0
   40    38    41    43   0.15000  1.0 3.0
   40    38    41    44   0.23200  1.0 3.0
   41    44    45    46   3.04450 -1.0 2.0
   41    44    45    49   1.49850  1.0 1.0
   41    44    45    49   1.53950 -1.0 2.0
   41    44   -47    33   2.37650  1.0 1.0
   41    44   -47    33  -0.36700 -1.0 2.0
   41    44    47   100  -0.86850  1.0 1.0
   41    44    47   100   0.62550 -1.0 2.0
   41    44    47   100  -1.75050  1.0 3.0
   41    44    47    48   0.00000  1.0 1.0
   42    41    44    45   0.00000  1.0 1.0
   42    41    44    47   0.00000  1.0 1.0
   43    41    44    45   0.00000  1.0 1.0
   43    41    44    47   0.00000  1.0 1.0
   44    45    49    50   0.75700  1.0 1.0
   44    45    49    50   0.34650 -1.0 2.0
   44    45    49    50   0.33000  1.0 3.0
   44    45    49    50  -0.28100 -1.0 4.0
   44    45    49    57   1.61600  1.0 1.0
   44    45    49    57  -0.04750 -1.0 2.0
   44    45    49    57   0.11700  1.0 3.0
   45    44    47    33   0.25950  1.0 1.0
   45    44    47    33   0.43850 -1.0 2.0
   45    44    47    33   2.61650  1.0 3.0
   45    44    47   100  -0.29800  1.0 1.0
   45    44    47   100   0.13950 -1.0 2.0
   45    44    47   100  -2.45650  1.0 3.0
   45    44    47    48   0.00000  1.0 1.0
   45    49    50    51   3.62500 -1.0 2.0
   45    49    50    52   3.62500 -1.0 2.0
   45    49    57    53   3.62500 -1.0 2.0
   46    45    49    50   1.05000 -1.0 2.0
   46    45    49    57   1.05000 -1.0 2.0
   49    50   -52    53   3.62500 -1.0 2.0
   50    49   -57    53   2.40000 -1.0 2.0
   50    52    53    54   3.62500 -1.0 2.0
   50    52   -53    57   3.62500 -1.0 2.0
   51    50    52    53   3.62500 -1.0 2.0
   52    53    54    55   0.00000  1.0 1.0
   52    53    54    56   0.00000  1.0 1.0
   52    53    54    58   0.04300 -1.0 2.0
   52    53   -57    49   3.62500 -1.0 2.0
   53    54    58    59   0.30150 -1.0 2.0
   53    54    58    60   0.65300  1.0 1.0
   53    54    58    60  -0.03850 -1.0 2.0
   53    54    58    60   0.33900  1.0 3.0
   54    53    57    49   3.62500 -1.0 2.0
   54    58    60    61   0.00000  1.0 1.0
   54    58    60    62   0.00000  1.0 1.0
   54    58    60    63   0.60050  1.0 1.0
   54    58    60    63   0.05600 -1.0 2.0
   54    58    60    63   0.26150  1.0 3.0
   55    54    58    59   0.00000  1.0 1.0
   55    54    58    60   0.00000  1.0 1.0
   56    54    58    59   0.00000  1.0 1.0
   56    54    58    60   0.00000  1.0 1.0
   58    60    63    64  -0.11250  1.0 3.0
   58    60    63    65  -0.98800  1.0 1.0
   58    60    63    65   0.48800 -1.0 2.0
   58    60    63    65   0.76800  1.0 3.0
   58    60    63    67  -0.09450  1.0 1.0
   58    60    63    67  -1.12950 -1.0 2.0
   58    60    63    67   0.54000  1.0 3.0
   59    58    60    61   0.00000  1.0 1.0
   59    58    60    62   0.00000  1.0 1.0
   59    58    60    63   0.30150 -1.0 2.0
   60    63    65    66   0.00000  1.0 1.0
   60    63    65    69   0.09850  1.0 1.0
   60    63    65    69   0.15250 -1.0 2.0
   60    63    65    69  -0.50650  1.0 3.0
   60    63    67    68  -0.11600  1.0 1.0
   60    63    67    68  -0.09450 -1.0 2.0
   60    63    67    68   0.21250  1.0 3.0
   61    60    63    64   0.15000  1.0 3.0
   61    60    63    65   0.15000  1.0 3.0
   61    60    63    67   0.23400  1.0 3.0
   62    60    63    64   0.15000  1.0 3.0
   62    60    63    65   0.15000  1.0 3.0
   62    60    63    67   0.23400  1.0 3.0
   63    65    69    70   7.00000 -1.0 2.0
   63    65    69    72   7.00000 -1.0 2.0
   64    63    65    66   0.33100  1.0 3.0
   64    63    65    69   0.00000  1.0 1.0
   64    63    67    68   0.19450  1.0 3.0
   65    63    67    68  -0.07800  1.0 1.0
   65    63    67    68  -0.21500 -1.0 2.0
   65    63    67    68  -0.03150  1.0 3.0
   65    69    70    71  -0.18600  1.0 3.0
   65    69    70    76   0.28850  1.0 1.0
   65    69    70    76   2.61350 -1.0 2.0
   65    69    70    76   0.78400  1.0 3.0
   65    69    72    73   0.00000  1.0 1.0
   65    69    72    74   0.00000  1.0 1.0
   65    69    72    75   0.00000  1.0 1.0
   66    65    69    70   7.00000 -1.0 2.0
   66    65    69    72   7.00000 -1.0 2.0
   69    70    76    77   7.00000 -1.0 2.0
   69    70    76    78   7.00000 -1.0 2.0
   70    69    72    73   0.00000  1.0 1.0
   70    69    72    74   0.00000  1.0 1.0
   70    69    72    75   0.00000  1.0 1.0
   70    76    78    79   0.00000  1.0 1.0
   70    76    78    80   0.00000  1.0 1.0
   70    76    78    81   0.62150  1.0 1.0
   70    76    78    81   0.42850 -1.0 2.0
   70    76    78    81  -0.68200  1.0 3.0
   71    70    76    77   7.00000 -1.0 2.0
   71    70    76    78   7.00000 -1.0 2.0
   76    78    81    82   0.00000  1.0 1.0
   76    78    81    83  -0.19250  1.0 1.0
   76    78    81    83  -0.00500 -1.0 2.0
   76    78    81    83   0.17000  1.0 3.0
   77    76    78    79   0.33100  1.0 3.0
   77    76    78    80   0.33100  1.0 3.0
   77    76    78    81   0.00000  1.0 1.0
   78    81    83    84   3.04450 -1.0 2.0
   78    81    83    85   1.49850  1.0 1.0
   78    81    83    85   1.53950 -1.0 2.0
   79    78    81    82   0.00000  1.0 1.0
   79    78    81    83   0.00000  1.0 1.0
   80    78    81    82   0.00000  1.0 1.0
   80    78    81    83   0.00000  1.0 1.0
   81    83    85    86   0.65100 -1.0 2.0
   81    83    85    87   0.49500  1.0 1.0
   81    83    85    87   1.31600 -1.0 2.0
   81    83    85    87  -0.02300  1.0 3.0
   82    81    83    84   2.45000 -1.0 2.0
   82    81    83    85   2.56700 -1.0 2.0
   83    85    87    88   7.00000 -1.0 2.0
   83    85    87    89   7.00000 -1.0 2.0
   84    83    85    86   0.00000  1.0 1.0
   84    83    85    87   1.00000 -1.0 2.0
   85    87    89    90   0.00000  1.0 1.0
   85    87    89    91   0.09850  1.0 1.0
   85    87    89    91   0.15250 -1.0 2.0
   85    87    89    91  -0.50650  1.0 3.0
   85    87    89    93   0.09850  1.0 1.0
   85    87    89    93   0.15250 -1.0 2.0
   85    87    89    93  -0.50650  1.0 3.0
   86    85    87    88   7.00000 -1.0 2.0
   86    85    87    89   7.00000 -1.0 2.0
   87    89    91    92   0.15000  1.0 3.0
   87    89    91    97   0.61850  1.0 1.0
   87    89    91    97  -0.22750 -1.0 2.0
   87    89    91    97   0.15300  1.0 3.0
   87    89    91    98   0.34400  1.0 1.0
   87    89    91    98   0.09450 -1.0 2.0
   87    89    91    98   0.11100  1.0 3.0
   87    89    93    94   0.15000  1.0 3.0
   87    89    93    95   0.15000  1.0 3.0
   87    89    93    96   0.15000  1.0 3.0
   88    87    89    90   0.33100  1.0 3.0
   88    87    89    91   0.00000  1.0 1.0
   88    87    89    93   0.00000  1.0 1.0
   89    91    97   100  -0.25900  1.0 1.0
   89    91    97   100  -0.47000 -1.0 2.0
   89    91    97   100   0.11750  1.0 3.0
   89    91    98    99   0.15000  1.0 3.0
   89    91    98   102   0.56750  1.0 1.0
   89    91    98   102  -0.07550 -1.0 2.0
   89    91    98   102   0.20000  1.0 3.0
   89    91    98   106   0.56750  1.0 1.0
   89    91    98   106  -0.07550 -1.0 2.0
   89    91    98   106   0.20000  1.0 3.0
   90    89    91    92   0.15000  1.0 3.0
   90    89    91    97   0.23400  1.0 3.0
   90    89    91    98   0.15000  1.0 3.0
   90    89    93    94   0.15000  1.0 3.0
   90    89    93    95   0.15000  1.0 3.0
   90    89    93    96   0.15000  1.0 3.0
   91    89    93    94   0.15000  1.0 3.0
   91    89    93    95   0.15000  1.0 3.0
   91    89    93    96   0.15000  1.0 3.0
   91    97   100   101   3.00000 -1.0 2.0
   91    97   100    47   1.63150  1.0 1.0
   91    97   100    47   2.92000 -1.0 2.0
   91    98   102   103   0.15000  1.0 3.0
   91    98   102   104   0.15000  1.0 3.0
   91    98   102   105   0.15000  1.0 3.0
   91    98   106   107   0.15000  1.0 3.0
   91    98   106   108   0.15000  1.0 3.0
   91    98   106   109   0.15000  1.0 3.0
   92    91    97   100   0.08050  1.0 3.0
   92    91    98    99   0.15000  1.0 3.0
   92    91    98   102   0.15000  1.0 3.0
   92    91    98   106   0.15000  1.0 3.0
   97    91    98    99   0.23400  1.0 3.0
   97    91    98   102   0.62750  1.0 1.0
   97    91    98   102  -0.30950 -1.0 2.0
   97    91    98   102   0.27300  1.0 3.0
   97    91    98   106   0.62750  1.0 1.0
   97    91    98   106  -0.30950 -1.0 2.0
   97    91    98   106   0.27300  1.0 3.0
   97   100    47    33   0.36750  1.0 3.0
   97   100    47    44   0.40000  1.0 3.0
   97   100    47    48   0.00000  1.0 1.0
  101   100    47    33   0.00000  1.0 1.0
  101   100    47    44   0.00000  1.0 1.0
  101   100    47    48   0.00000  1.0 1.0
   47    33    38    39   0.15000  1.0 3.0
   47    33    38    40   0.15000  1.0 3.0
   47    33   -38    41   0.65000  1.0 1.0
   47    33   -38    41  -0.02500 -1.0 2.0
   47    33   -38    41   0.10000  1.0 3.0
   47    44    45    46   3.04450 -1.0 2.0
   47    44    45    49   1.49850  1.0 1.0
   47    44    45    49   1.53950 -1.0 2.0
   98    91    97   100  -0.25900  1.0 1.0
   98    91    97   100  -0.47000 -1.0 2.0
   98    91    97   100   0.11750  1.0 3.0
   99    98   102   103   0.15000  1.0 3.0
   99    98   102   104   0.15000  1.0 3.0
   99    98   102   105   0.15000  1.0 3.0
   99    98   106   107   0.15000  1.0 3.0
   99    98   106   108   0.15000  1.0 3.0
   99    98   106   109   0.15000  1.0 3.0
  102    98   106   107   0.15000  1.0 3.0
  102    98   106   108   0.15000  1.0 3.0
  102    98   106   109   0.15000  1.0 3.0
  106    98   102   103   0.15000  1.0 3.0
  106    98   102   104   0.15000  1.0 3.0
  106    98   102   105   0.15000  1.0 3.0
   93    89    91    92   0.15000  1.0 3.0
   93    89    91    97   0.62750  1.0 1.0
   93    89    91    97  -0.30950 -1.0 2.0
   93    89    91    97   0.27300  1.0 3.0
   93    89    91    98   0.56750  1.0 1.0
   93    89    91    98  -0.07550 -1.0 2.0
   93    89    91    98   0.20000  1.0 3.0
   72    69    70    71   0.00000  1.0 1.0
   72    69    70    76  -0.18600  1.0 3.0
   67    63    65    66   0.00000  1.0 1.0
   67    63    65    69   0.67800  1.0 1.0
   67    63    65    69   0.47050 -1.0 2.0
   67    63    65    69  -0.62500  1.0 3.0
   57    49    50    51   3.62500 -1.0 2.0
   57    49   -50    52   3.62500 -1.0 2.0
   57    53    54    55   0.00000  1.0 1.0
   57    53    54    56   0.00000  1.0 1.0
   57    53    54    58   0.04300 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   47    45    44    41   1.00000 -1.0 2.0
   44    49    45    46  10.50000 -1.0 2.0
   50    57    49    45   4.00000 -1.0 2.0
   52    51    50    49   1.10000 -1.0 2.0
   54    57    53    52   4.00000 -1.0 2.0
   54    60    58    59  10.50000 -1.0 2.0
   63    66    65    69   1.10000 -1.0 2.0
   70    72    69    65   1.10000 -1.0 2.0
   69    71    70    76   1.10000 -1.0 2.0
   78    77    76    70   1.10000 -1.0 2.0
   82    83    81    78   1.00000 -1.0 2.0
   81    85    83    84  10.50000 -1.0 2.0
   83    86    85    87   1.10000 -1.0 2.0
   89    88    87    85   1.10000 -1.0 2.0
   97    47   100   101  10.50000 -1.0 2.0
END
