* LIGAND DATABASE FILE (OPLS2005)
*
001     110   114    207    310     585
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02102    91.89108   -65.97358
    3     1 S   H    _H1_     3     1.02029    88.65392    42.70310
    4     1 S   H    _H2_     4     1.02106    32.92756   171.40714
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08491   110.62044    58.69465
   26    24 S   HC   HB22    34     1.08519   110.01707   179.18699
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   C4T  _C15    36     1.87592    96.43897  -158.12826
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CO4  _C14    37     1.53418   101.72913   -40.03227
   38    37 S   O    _O37    38     1.22954   126.65300    96.63603
   39    33 S   C4T  _C16    49     1.61033   122.18253  -160.71336
   40    33 S   C4T  _C18    64     1.52511   113.43575   101.60512
   41    37 S   OS   _O36    39     1.42427   112.78511   -82.15329
   42    39 S   C4T  _C17    50     1.52489    83.61562   -76.08200
   43    42 S   Cl   Cl1_    51     1.88092   114.58333    90.93692
   44    40 S   CT   _C30    65     1.53087   111.92965  -151.93007
   45    44 S   HC   _H29    66     1.08778   109.64678   -35.06308
   46    44 S   HC   _H30    67     1.08747   109.65666  -155.05862
   47    44 S   HC   _H31    68     1.08745   109.63693    84.88199
   48    39 S   CT   _C31    88     1.53052   121.13299   172.10623
   49    48 S   HC   _H32    89     1.08882   109.68373    60.84909
   50    48 S   HC   _H33    90     1.08752   109.65965   -59.13645
   51    48 S   HC   _H34    91     1.08815   109.67177  -179.16210
   52    41 S   CA   _C12    40     1.44000   123.08440    -6.14819
   53    42 S   CO4  _C25    52     1.53427   128.53286  -144.02025
   54    53 S   O    _O39    53     1.23024   126.63473   -36.73451
   55    52 S   CA   _C13    41     1.39198   117.00680   160.80646
   56    55 S   HA   _H15    42     1.08558   120.81895    -0.65222
   57    53 S   OS   _O38    54     1.42451   112.78592   144.66463
   58    55 S   CA   _C8_    43     1.39213   118.50214   179.46624
   59    57 S   CA   _C24    55     1.44004   123.05609    -6.15972
   60    58 S   CA   _C9_    44     1.39755   120.19559    -0.32984
   61    60 S   HA   _H13    45     1.08651   120.08890  -179.83331
   62    59 S   CA   _C23    56     1.39279   117.02369   160.82961
   63    62 S   HA   _H18    57     1.08528   120.68493    -0.73115
   64    58 S   OS   _O35    92     1.36180   119.95507   179.76593
   65    60 S   CA   _C10    46     1.39961   120.58602    -0.13122
   66    65 S   HA   _H14    47     1.08636   119.23016  -179.05643
   67    62 S   CA   _C22    58     1.39132   118.46637   179.43559
   68    64 S   P1   _P1_    93     1.62596   126.66831    29.93841
   69    68 S   ST   _S1_    94     1.94990   116.87792    46.86540
   70    52 S   CA   _C11    48     1.41710   120.10305   -20.47940
   71    67 S   CA   _C21    59     1.39799   120.26994    -0.29208
   72    71 S   HA   _H17    60     1.08628   120.10385  -179.78150
   73    67 S   OS   _O40    69     1.36210   119.90859   179.75055
   74    68 S   OS   _O33    95     1.62818   101.26070   -80.01712
   75    68 S   OS   _O34   103     1.62710   101.92496   176.13097
   76    71 S   CA   _C20    61     1.39927   120.55538    -0.19180
   77    76 S   HA   _H16    62     1.08642   119.14958  -178.88040
   78    73 S   P1   _P2_    70     1.62575   126.68502   -30.05646
   79    78 S   ST   _S2_    71     1.94998   116.88130   -53.14491
   80    74 S   CT   _C5_    96     1.41872   119.85713   -59.94950
   81    80 S   HC   _H6_    97     1.09412   108.73773   -59.38031
   82    80 S   HC   _H7_    98     1.09384   108.77258    59.30859
   83    75 S   CT   _C6_   104     1.41777   119.79538   -60.04440
   84    83 S   HC   _H8_   105     1.09417   108.78636   -59.32558
   85    83 S   HC   _H9_   106     1.09458   108.75546    59.41896
   86    59 S   CA   _C19    63     1.41687   120.10455   -20.47726
   87    78 S   OS   _O41    72     1.62909   101.24581   179.96044
   88    78 S   OS   _O42    80     1.62707   101.92348    76.12153
   89    80 S   CT   _C4_    99     1.51371   108.99995   179.98022
   90    89 S   HC   _H3_   100     1.09348   110.88242   -60.49237
   91    89 S   HC   _H4_   101     1.09502   110.63845    60.38583
   92    89 S   HC   _H5_   102     1.09558   110.58863   178.68463
   93    83 S   CT   _C7_   107     1.51373   109.01871  -180.00000
   94    93 S   HC   _H10   108     1.09340   110.89816   -60.45995
   95    93 S   HC   _H11   109     1.09465   110.63178    60.41154
   96    93 S   HC   _H12   110     1.09482   110.61235   178.72589
   97    87 S   CT   _C26    73     1.41781   119.79221    59.99247
   98    97 S   HC   _H19    74     1.09346   108.83636   -59.41469
   99    97 S   HC   _H20    75     1.09389   108.78157    59.40929
  100    88 S   CT   _C28    81     1.41789   119.77111   160.02691
  101   100 S   HC   _H24    82     1.09458   108.79073   -59.48870
  102   100 S   HC   _H25    83     1.09395   108.82800    59.31140
  103    97 S   CT   _C27    76     1.51401   108.96723  -180.00000
  104   103 S   HC   _H21    77     1.09424   110.89874   -60.46114
  105   103 S   HC   _H22    78     1.09526   110.66566    60.39674
  106   103 S   HC   _H23    79     1.09529   110.61942   178.72191
  107   100 S   CT   _C29    84     1.51369   109.02227   180.00000
  108   107 S   HC   _H26    85     1.09342   110.89497   -60.48948
  109   107 S   HC   _H27    86     1.09527   110.65137    60.34838
  110   107 S   HC   _H28    87     1.09494   110.67618   178.67766
  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  11   5   4   3
  22   2   1   1  11   4  19  18   6  18   7   7   3   2   1   7
   3   2   1   8   6   2   8   4   6  10   8   6   4   8   4   7
   2   1  10  11   4   1   6   4   7   9   8   2   1  11   4   6
   5   4   6   5   4   1   9   8   3   2   1   1   3   2   1   1
   6   5   4   6   5   4   3   2   1   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    39    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    70    39    42    86    40    44    48  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    52    65    70    39    42    43    53    59    76    86    40    44    45    46    47    48    49    50    51  
   35    36  
   36  
    0  
   38    41    52    55    70    39    42    86    40    44    48  
   41    52    39    40  
   42    43    53    54    57    86    40    44    48    49    50    51    41    52    55    60    65    66    70  
   44    45    46    47    48    41    42    43    53    54    57    59    62    70    71    76    77    86  
   52    55    56    58    65    70  
   43    53    54    57    59    76    86    44    45    46    47    48    49    50    51    52    65    70  
   53    54    57    86    44    48    70  
   45    46    47    53    59    76    86  
   46    47    86  
   47    86  
   86  
   49    50    51    52    53    65    70  
   50    51    70  
   51    70  
   70  
   55    56    58    60    65    66    70    64  
   54    57    59    62    86    70  
   57    59  
   56    58    60    61    65    70    64    68  
   58    60    70    64  
   59    62    63    67    76    86  
   60    61    65    66    70    64    68    69    74    75  
   62    63    67    71    76    77    86    73  
   61    65    66    70    64    68  
   65    66    70    64  
   63    67    71    72    76    86    73    78  
   67    71    86    73  
   68    69    74    80    75    83    65  
   66    70  
   70  
   71    72    76    77    86    73    78    79    87    88  
   69    74    80    81    82    89    75    83    84    85    93  
   74    80    75    83  
    0  
   72    76    77    86    73    78  
   76    77    86    73  
   78    79    87    97    88   100    76  
   80    81    82    89    90    91    92    75    83  
   83    84    85    93    94    95    96    80  
   77    86  
   86  
   79    87    97    98    99   103    88   100   101   102   107  
   87    97    88   100  
   81    82    89    90    91    92  
   82    89    90    91    92  
   89    90    91    92  
   84    85    93    94    95    96  
   85    93    94    95    96  
   93    94    95    96  
    0  
   97    98    99   103   104   105   106    88   100  
  100   101   102   107   108   109   110    97  
   90    91    92  
   91    92  
   92  
    0  
   94    95    96  
   95    96  
   96  
    0  
   98    99   103   104   105   106  
   99   103   104   105   106  
  103   104   105   106  
  101   102   107   108   109   110  
  102   107   108   109   110  
  107   108   109   110  
  104   105   106  
  105   106  
  106  
    0  
  108   109   110  
  109   110  
  110  
    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  -0.324000   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   0.256900   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   3.7500   0.1050   0.409600   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   39   3.5000   0.0660   0.056200   1.9750   1.7500   0.005000000  -0.741685710
   40   3.5000   0.0660   0.056200   1.9750   1.7500   0.005000000  -0.741685710
   41   3.0000   0.1700  -0.215000   1.7660   1.5600   0.020110767  -0.896042159
   42   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   43   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   44   3.5000   0.0660  -0.121200   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.121200   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0700   0.135000   2.5000   1.7750   0.001000000  -0.843144165
   53   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   55   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   56   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   57   3.0000   0.1700  -0.215000   1.7660   1.5600   0.020110767  -0.896042159
   58   3.5500   0.0700   0.100000   2.5000   1.7750   0.001000000  -0.843144165
   59   3.5500   0.0700   0.135000   2.5000   1.7750   0.001000000  -0.843144165
   60   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   61   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   62   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   64   2.8500   0.1400  -0.288200   1.7660   1.5600   0.020110767  -0.896042159
   65   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   67   3.5500   0.0700   0.100000   2.5000   1.7750   0.001000000  -0.843144165
   68   3.7400   0.2000   1.154100   2.1070   1.8700   0.005000000   0.000000000
   69   4.2500   0.5000  -0.589500   2.3875   2.1250   0.025682759  -1.666211680
   70   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   71   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   72   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   73   2.8500   0.1400  -0.288200   1.7660   1.5600   0.020110767  -0.896042159
   74   2.8500   0.1400  -0.461100   1.5900   1.4000   0.020110767  -0.896042159
   75   2.8500   0.1400  -0.461100   1.5900   1.4000   0.020110767  -0.896042159
   76   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   77   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   78   3.7400   0.2000   1.154100   2.1070   1.8700   0.005000000   0.000000000
   79   4.2500   0.5000  -0.589500   2.3875   2.1250   0.025682759  -1.666211680
   80   3.5000   0.0660   0.152900   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   3.5000   0.0660   0.152900   1.9750   1.7500   0.005000000  -0.741685710
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   87   2.8500   0.1400  -0.461100   1.5900   1.4000   0.020110767  -0.896042159
   88   2.8500   0.1400  -0.461100   1.5900   1.4000   0.020110767  -0.896042159
   89   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   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   3.5000   0.0660   0.152900   1.9750   1.7500   0.005000000  -0.741685710
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   3.5000   0.0660   0.152900   1.9750   1.7500   0.005000000  -0.741685710
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  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
  110   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    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   200.000  1.824
   33    37   265.000  1.493
   33    39   268.000  1.529
   33    40   268.000  1.529
   37    38   570.000  1.229
   37    41   214.000  1.327
   41    52   450.000  1.364
   52    55   469.000  1.400
   52    70   469.000  1.400
   55    56   367.000  1.080
   55    58   469.000  1.400
   58    60   469.000  1.400
   58    64   450.000  1.364
   60    61   367.000  1.080
   60    65   469.000  1.400
   65    66   367.000  1.080
   65    70   469.000  1.400
   70    39   317.000  1.510
   39    42   268.000  1.529
   39    48   260.000  1.519
   42    43   185.000  1.815
   42    53   265.000  1.493
   42    40   268.000  1.529
   53    54   570.000  1.229
   53    57   214.000  1.327
   57    59   450.000  1.364
   59    62   469.000  1.400
   59    86   469.000  1.400
   62    63   367.000  1.080
   62    67   469.000  1.400
   67    71   469.000  1.400
   67    73   450.000  1.364
   71    72   367.000  1.080
   71    76   469.000  1.400
   76    77   367.000  1.080
   76    86   469.000  1.400
   86    40   317.000  1.510
   40    44   260.000  1.519
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   340.000  1.090
   73    78   405.000  1.623
   78    79   270.000  1.959
   78    87   405.000  1.623
   78    88   405.000  1.623
   87    97   320.000  1.410
   97    98   340.000  1.090
   97    99   340.000  1.090
   97   103   268.000  1.529
  103   104   340.000  1.090
  103   105   340.000  1.090
  103   106   340.000  1.090
   88   100   320.000  1.410
  100   101   340.000  1.090
  100   102   340.000  1.090
  100   107   268.000  1.529
  107   108   340.000  1.090
  107   109   340.000  1.090
  107   110   340.000  1.090
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   340.000  1.090
   64    68   405.000  1.623
   68    69   270.000  1.959
   68    74   405.000  1.623
   68    75   405.000  1.623
   74    80   320.000  1.410
   80    81   340.000  1.090
   80    82   340.000  1.090
   80    89   268.000  1.529
   89    90   340.000  1.090
   89    91   340.000  1.090
   89    92   340.000  1.090
   75    83   320.000  1.410
   83    84   340.000  1.090
   83    85   340.000  1.090
   83    93   268.000  1.529
   93    94   340.000  1.090
   93    95   340.000  1.090
   93    96   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    85.00000   99.86700
   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  110.18000
   29    33    39    65.00000  119.05700
   29    33    40    65.00000  119.05700
   33    37    38    65.00000  127.62700
   33    37    41    81.00000  111.40000
   33    39    70    50.00000  118.80000
   33    39    42    63.00000   92.00000
   33    39    48    65.00000  119.52000
   33    40    42    63.00000   92.00000
   33    40    86    50.00000  118.80000
   33    40    44    65.00000  119.52000
   37    41    52    85.00000  115.98000
   41    37    38    83.00000  123.40000
   41    52    55    70.00000  120.00000
   41    52    70    70.00000  120.00000
   52    55    56    35.00000  120.00000
   52    55    58    63.00000  120.00000
   52    70    65    63.00000  120.00000
   52    70    39    70.00000  120.00000
   55    58    60    63.00000  120.00000
   55    58    64    70.00000  120.00000
   58    55    56    35.00000  120.00000
   58    60    61    35.00000  120.00000
   58    60    65    63.00000  120.00000
   58    64    68    70.00000  122.28900
   60    65    66    35.00000  120.00000
   60    65    70    63.00000  120.00000
   65    60    61    35.00000  120.00000
   65    70    39    70.00000  120.00000
   70    52    55    63.00000  120.00000
   70    65    66    35.00000  120.00000
   70    39    42    50.00000  118.80000
   70    39    48    70.00000  112.17500
   39    33    37    80.00000  115.07000
   39    42    43    65.00000  118.08000
   39    42    53    80.00000  115.07000
   39    42    40    63.00000   92.00000
   39    48    49    45.00000  111.22300
   39    48    50    45.00000  111.22300
   39    48    51    45.00000  111.22300
   42    53    54    65.00000  127.62700
   42    53    57    81.00000  111.40000
   42    40    86    50.00000  118.80000
   42    40    44    65.00000  119.52000
   53    42    43    70.00000  110.66000
   53    57    59    85.00000  115.98000
   57    53    54    83.00000  123.40000
   57    59    62    70.00000  120.00000
   57    59    86    70.00000  120.00000
   59    62    63    35.00000  120.00000
   59    62    67    63.00000  120.00000
   59    86    76    63.00000  120.00000
   59    86    40    70.00000  120.00000
   62    67    71    63.00000  120.00000
   62    67    73    70.00000  120.00000
   67    62    63    35.00000  120.00000
   67    71    72    35.00000  120.00000
   67    71    76    63.00000  120.00000
   67    73    78    70.00000  122.28900
   71    76    77    35.00000  120.00000
   71    76    86    63.00000  120.00000
   76    71    72    35.00000  120.00000
   76    86    40    70.00000  120.00000
   86    59    62    63.00000  120.00000
   86    76    77    35.00000  120.00000
   86    40    44    70.00000  112.17500
   40    33    37    80.00000  115.07000
   40    33    39    63.00000   92.00000
   40    42    43    65.00000  118.08000
   40    42    53    80.00000  115.07000
   40    44    45    45.00000  111.22300
   40    44    46    45.00000  111.22300
   40    44    47    45.00000  111.22300
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    33.00000  107.80000
   73    67    71    70.00000  120.00000
   73    78    79    80.00000  117.31900
   73    78    87   120.00000  102.38000
   73    78    88   120.00000  102.38000
   78    87    97    75.00000  119.24600
   78    88   100    75.00000  119.24600
   87    78    79    80.00000  117.31900
   87    97    98    35.00000  109.50000
   87    97    99    35.00000  109.50000
   87    97   103    50.00000  109.50000
   97   103   104    37.50000  110.70000
   97   103   105    37.50000  110.70000
   97   103   106    37.50000  110.70000
   99    97    98    33.00000  107.80000
  103    97    98    37.50000  110.70000
  103    97    99    37.50000  110.70000
  105   103   104    33.00000  107.80000
  106   103   104    33.00000  107.80000
  106   103   105    33.00000  107.80000
   88    78    79    80.00000  117.31900
   88    78    87   120.00000  102.38000
   88   100   101    35.00000  109.50000
   88   100   102    35.00000  109.50000
   88   100   107    50.00000  109.50000
  100   107   108    37.50000  110.70000
  100   107   109    37.50000  110.70000
  100   107   110    37.50000  110.70000
  102   100   101    33.00000  107.80000
  107   100   101    37.50000  110.70000
  107   100   102    37.50000  110.70000
  109   107   108    33.00000  107.80000
  110   107   108    33.00000  107.80000
  110   107   109    33.00000  107.80000
   48    39    42    65.00000  119.52000
   50    48    49    33.00000  107.80000
   51    48    49    33.00000  107.80000
   51    48    50    33.00000  107.80000
   64    58    60    70.00000  120.00000
   64    68    69    80.00000  117.31900
   64    68    74   120.00000  102.38000
   64    68    75   120.00000  102.38000
   68    74    80    75.00000  119.24600
   68    75    83    75.00000  119.24600
   74    68    69    80.00000  117.31900
   74    80    81    35.00000  109.50000
   74    80    82    35.00000  109.50000
   74    80    89    50.00000  109.50000
   80    89    90    37.50000  110.70000
   80    89    91    37.50000  110.70000
   80    89    92    37.50000  110.70000
   82    80    81    33.00000  107.80000
   89    80    81    37.50000  110.70000
   89    80    82    37.50000  110.70000
   91    89    90    33.00000  107.80000
   92    89    90    33.00000  107.80000
   92    89    91    33.00000  107.80000
   75    68    69    80.00000  117.31900
   75    68    74   120.00000  102.38000
   75    83    84    35.00000  109.50000
   75    83    85    35.00000  109.50000
   75    83    93    50.00000  109.50000
   83    93    94    37.50000  110.70000
   83    93    95    37.50000  110.70000
   83    93    96    37.50000  110.70000
   85    83    84    33.00000  107.80000
   93    83    84    37.50000  110.70000
   93    83    85    37.50000  110.70000
   95    93    94    33.00000  107.80000
   96    93    94    33.00000  107.80000
   96    93    95    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  -0.25000 -1.0 2.0
   20    24    29    33  -0.01800  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   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    39   0.25150  1.0 1.0
   24    29    33    39  -1.17200 -1.0 2.0
   24    29    33    39   0.53050  1.0 3.0
   24    29    33    40   0.25150  1.0 1.0
   24    29    33    40  -1.17200 -1.0 2.0
   24    29    33    40   0.53050  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    38   0.30150 -1.0 2.0
   29    33    37    41   0.40000  1.0 3.0
   29    33    39    70   0.00000  1.0 1.0
   29    33    39    42   0.44750  1.0 1.0
   29    33    39    42  -0.17800 -1.0 2.0
   29    33    39    42   0.20200  1.0 3.0
   29    33    39    48   0.44750  1.0 1.0
   29    33    39    48  -0.17800 -1.0 2.0
   29    33    39    48   0.20200  1.0 3.0
   29    33   -40    42   0.44750  1.0 1.0
   29    33   -40    42  -0.17800 -1.0 2.0
   29    33   -40    42   0.20200  1.0 3.0
   29    33    40    86   0.00000  1.0 1.0
   29    33    40    44   0.44750  1.0 1.0
   29    33    40    44  -0.17800 -1.0 2.0
   29    33    40    44   0.20200  1.0 3.0
   33    37    41    52   0.75600  1.0 1.0
   33    37    41    52   1.63000 -1.0 2.0
   33    39    42    43   0.16150  1.0 1.0
   33    39    42    43   0.42350 -1.0 2.0
   33    39    42    43   0.33300  1.0 3.0
   33    39    42    53   0.00000  1.0 1.0
   33    39   -42    40   0.00000  1.0 1.0
   33    39    48    49   0.00000  1.0 1.0
   33    39    48    50   0.00000  1.0 1.0
   33    39    48    51   0.00000  1.0 1.0
   33    40    44    45   0.00000  1.0 1.0
   33    40    44    46   0.00000  1.0 1.0
   33    40    44    47   0.00000  1.0 1.0
   37    33    39    70   0.00000  1.0 1.0
   37    33    39    42   0.00000  1.0 1.0
   37    33    39    48  -0.95700  1.0 1.0
   37    33    39    48  -0.18200 -1.0 2.0
   37    33    39    48   0.29450  1.0 3.0
   37    33   -40    42   0.00000  1.0 1.0
   37    33    40    86   0.00000  1.0 1.0
   37    33    40    44  -0.95700  1.0 1.0
   37    33    40    44  -0.18200 -1.0 2.0
   37    33    40    44   0.29450  1.0 3.0
   37    41    52    55   0.01300  1.0 1.0
   37    41    52    55   0.97950 -1.0 2.0
   37    41    52    55  -0.55700  1.0 3.0
   37    41   -52    70   0.01300  1.0 1.0
   37    41   -52    70   0.97950 -1.0 2.0
   37    41   -52    70  -0.55700  1.0 3.0
   38    37    41    52   3.00000 -1.0 2.0
   41    52    55    56   3.62500 -1.0 2.0
   41    52    55    58   3.62500 -1.0 2.0
   41    52    70    65   3.62500 -1.0 2.0
   41    52    70    39   3.62500 -1.0 2.0
   52    55    58    60   3.62500 -1.0 2.0
   52    55    58    64   3.62500 -1.0 2.0
   52    70   -39    33   0.04150 -1.0 2.0
   52    70    39    42   0.04150 -1.0 2.0
   52    70    39    48   0.04150 -1.0 2.0
   55    52    70    65   3.62500 -1.0 2.0
   55    52    70    39   3.62500 -1.0 2.0
   55    58    60    61   3.62500 -1.0 2.0
   55    58   -60    65   3.62500 -1.0 2.0
   55    58    64    68   0.54700 -1.0 2.0
   56    55    58    60   3.62500 -1.0 2.0
   56    55    58    64   3.62500 -1.0 2.0
   58    60    65    66   3.62500 -1.0 2.0
   58    60    65    70   3.62500 -1.0 2.0
   58    64    68    69   0.15000  1.0 3.0
   58    64    68    74   0.88300  1.0 1.0
   58    64    68    74   0.16450 -1.0 2.0
   58    64    68    74   0.32850  1.0 3.0
   58    64    68    75   0.88300  1.0 1.0
   58    64    68    75   0.16450 -1.0 2.0
   58    64    68    75   0.32850  1.0 3.0
   60    58    64    68   0.54700 -1.0 2.0
   60    65   -70    52   3.62500 -1.0 2.0
   60    65    70    39   3.62500 -1.0 2.0
   61    60    65    66   3.62500 -1.0 2.0
   61    60    65    70   3.62500 -1.0 2.0
   65    70    39    33   0.04150 -1.0 2.0
   65    70    39    42   0.04150 -1.0 2.0
   65    70    39    48   0.04150 -1.0 2.0
   66    65    70    52   3.62500 -1.0 2.0
   66    65    70    39   3.62500 -1.0 2.0
   70    52    55    56   3.62500 -1.0 2.0
   70    52   -55    58   3.62500 -1.0 2.0
   70    39    42    43   0.00000  1.0 1.0
   70    39    42    53   0.00000  1.0 1.0
   70    39    42    40  -0.03700  1.0 1.0
   70    39    42    40   0.37200 -1.0 2.0
   70    39    42    40  -0.47300  1.0 3.0
   70    39    48    49   0.43200  1.0 3.0
   70    39    48    50   0.43200  1.0 3.0
   70    39    48    51   0.43200  1.0 3.0
   39    33    37    38  -0.11250  1.0 1.0
   39    33    37    38   0.11400 -1.0 2.0
   39    33    37    38  -0.28950  1.0 3.0
   39    33   -37    41   0.36750  1.0 3.0
   39    33   -40    42   0.00000  1.0 1.0
   39    33    40    86  -0.03700  1.0 1.0
   39    33    40    86   0.37200 -1.0 2.0
   39    33    40    86  -0.47300  1.0 3.0
   39    33    40    44  -0.70950  1.0 1.0
   39    33    40    44   0.38400 -1.0 2.0
   39    42    53    54  -0.11250  1.0 1.0
   39    42    53    54   0.11400 -1.0 2.0
   39    42    53    54  -0.28950  1.0 3.0
   39    42    53    57   0.36750  1.0 3.0
   39    42   -40    33   0.00000  1.0 1.0
   39    42   -40    86  -0.03700  1.0 1.0
   39    42   -40    86   0.37200 -1.0 2.0
   39    42   -40    86  -0.47300  1.0 3.0
   39    42   -40    44  -0.70950  1.0 1.0
   39    42   -40    44   0.38400 -1.0 2.0
   42    39    48    49   0.00000  1.0 1.0
   42    39    48    50   0.00000  1.0 1.0
   42    39    48    51   0.00000  1.0 1.0
   42    53    57    59   0.75600  1.0 1.0
   42    53    57    59   1.63000 -1.0 2.0
   42    40    44    45   0.00000  1.0 1.0
   42    40    44    46   0.00000  1.0 1.0
   42    40    44    47   0.00000  1.0 1.0
   43    42    53    54   0.30150 -1.0 2.0
   43    42    53    57   0.40000  1.0 3.0
   43    42   -40    33   0.16150  1.0 1.0
   43    42   -40    33   0.42350 -1.0 2.0
   43    42   -40    33   0.33300  1.0 3.0
   43    42    40    86   0.00000  1.0 1.0
   43    42    40    44   0.35600  1.0 1.0
   43    42    40    44  -0.14650 -1.0 2.0
   43    42    40    44   0.33350  1.0 3.0
   53    42   -40    33   0.00000  1.0 1.0
   53    42    40    86   0.00000  1.0 1.0
   53    42    40    44  -0.95700  1.0 1.0
   53    42    40    44  -0.18200 -1.0 2.0
   53    42    40    44   0.29450  1.0 3.0
   53    57    59    62   0.01300  1.0 1.0
   53    57    59    62   0.97950 -1.0 2.0
   53    57    59    62  -0.55700  1.0 3.0
   53    57   -59    86   0.01300  1.0 1.0
   53    57   -59    86   0.97950 -1.0 2.0
   53    57   -59    86  -0.55700  1.0 3.0
   54    53    57    59   3.00000 -1.0 2.0
   57    59    62    63   3.62500 -1.0 2.0
   57    59    62    67   3.62500 -1.0 2.0
   57    59    86    76   3.62500 -1.0 2.0
   57    59    86    40   3.62500 -1.0 2.0
   59    62    67    71   3.62500 -1.0 2.0
   59    62    67    73   3.62500 -1.0 2.0
   59    86    40    33   0.04150 -1.0 2.0
   59    86   -40    42   0.04150 -1.0 2.0
   59    86    40    44   0.04150 -1.0 2.0
   62    59    86    76   3.62500 -1.0 2.0
   62    59    86    40   3.62500 -1.0 2.0
   62    67    71    72   3.62500 -1.0 2.0
   62    67   -71    76   3.62500 -1.0 2.0
   62    67    73    78   0.54700 -1.0 2.0
   63    62    67    71   3.62500 -1.0 2.0
   63    62    67    73   3.62500 -1.0 2.0
   67    71    76    77   3.62500 -1.0 2.0
   67    71    76    86   3.62500 -1.0 2.0
   67    73    78    79   0.15000  1.0 3.0
   67    73    78    87   0.88300  1.0 1.0
   67    73    78    87   0.16450 -1.0 2.0
   67    73    78    87   0.32850  1.0 3.0
   67    73    78    88   0.88300  1.0 1.0
   67    73    78    88   0.16450 -1.0 2.0
   67    73    78    88   0.32850  1.0 3.0
   71    67    73    78   0.54700 -1.0 2.0
   71    76   -86    59   3.62500 -1.0 2.0
   71    76    86    40   3.62500 -1.0 2.0
   72    71    76    77   3.62500 -1.0 2.0
   72    71    76    86   3.62500 -1.0 2.0
   76    86    40    33   0.04150 -1.0 2.0
   76    86    40    42   0.04150 -1.0 2.0
   76    86    40    44   0.04150 -1.0 2.0
   77    76    86    59   3.62500 -1.0 2.0
   77    76    86    40   3.62500 -1.0 2.0
   86    59    62    63   3.62500 -1.0 2.0
   86    59   -62    67   3.62500 -1.0 2.0
   86    40    44    45   0.43200  1.0 3.0
   86    40    44    46   0.43200  1.0 3.0
   86    40    44    47   0.43200  1.0 3.0
   40    33    37    38  -0.11250  1.0 1.0
   40    33    37    38   0.11400 -1.0 2.0
   40    33    37    38  -0.28950  1.0 3.0
   40    33    37    41   0.36750  1.0 3.0
   40    33   -39    70  -0.03700  1.0 1.0
   40    33   -39    70   0.37200 -1.0 2.0
   40    33   -39    70  -0.47300  1.0 3.0
   40    33   -39    42   0.00000  1.0 1.0
   40    33    39    48  -0.70950  1.0 1.0
   40    33    39    48   0.38400 -1.0 2.0
   40    42    53    54  -0.11250  1.0 1.0
   40    42    53    54   0.11400 -1.0 2.0
   40    42    53    54  -0.28950  1.0 3.0
   40    42   -53    57   0.36750  1.0 3.0
   73    67    71    72   3.62500 -1.0 2.0
   73    67    71    76   3.62500 -1.0 2.0
   73    78    87    97   0.91800  1.0 1.0
   73    78    87    97   0.22900 -1.0 2.0
   73    78    87    97   0.32050  1.0 3.0
   73    78    88   100   0.91800  1.0 1.0
   73    78    88   100   0.22900 -1.0 2.0
   73    78    88   100   0.32050  1.0 3.0
   78    87    97    98   0.03000  1.0 3.0
   78    87    97    99   0.03000  1.0 3.0
   78    87    97   103  -2.65550  1.0 1.0
   78    87    97   103  -0.22350 -1.0 2.0
   78    87    97   103   0.24150  1.0 3.0
   78    88   100   101   0.03000  1.0 3.0
   78    88   100   102   0.03000  1.0 3.0
   78    88   100   107  -2.65550  1.0 1.0
   78    88   100   107  -0.22350 -1.0 2.0
   78    88   100   107   0.24150  1.0 3.0
   79    78    87    97   0.15000  1.0 3.0
   79    78    88   100   0.15000  1.0 3.0
   87    78    88   100   0.91800  1.0 1.0
   87    78    88   100   0.22900 -1.0 2.0
   87    78    88   100   0.32050  1.0 3.0
   87    97   103   104   0.23400  1.0 3.0
   87    97   103   105   0.23400  1.0 3.0
   87    97   103   106   0.23400  1.0 3.0
   98    97   103   104   0.15000  1.0 3.0
   98    97   103   105   0.15000  1.0 3.0
   98    97   103   106   0.15000  1.0 3.0
   99    97   103   104   0.15000  1.0 3.0
   99    97   103   105   0.15000  1.0 3.0
   99    97   103   106   0.15000  1.0 3.0
   88    78    87    97   0.91800  1.0 1.0
   88    78    87    97   0.22900 -1.0 2.0
   88    78    87    97   0.32050  1.0 3.0
   88   100   107   108   0.23400  1.0 3.0
   88   100   107   109   0.23400  1.0 3.0
   88   100   107   110   0.23400  1.0 3.0
  101   100   107   108   0.15000  1.0 3.0
  101   100   107   109   0.15000  1.0 3.0
  101   100   107   110   0.15000  1.0 3.0
  102   100   107   108   0.15000  1.0 3.0
  102   100   107   109   0.15000  1.0 3.0
  102   100   107   110   0.15000  1.0 3.0
   48    39    42    43   0.35600  1.0 1.0
   48    39    42    43  -0.14650 -1.0 2.0
   48    39    42    43   0.33350  1.0 3.0
   48    39    42    53  -0.95700  1.0 1.0
   48    39    42    53  -0.18200 -1.0 2.0
   48    39    42    53   0.29450  1.0 3.0
   48    39   -42    40  -0.70950  1.0 1.0
   48    39   -42    40   0.38400 -1.0 2.0
   64    58    60    61   3.62500 -1.0 2.0
   64    58    60    65   3.62500 -1.0 2.0
   64    68    74    80   0.91800  1.0 1.0
   64    68    74    80   0.22900 -1.0 2.0
   64    68    74    80   0.32050  1.0 3.0
   64    68    75    83   0.91800  1.0 1.0
   64    68    75    83   0.22900 -1.0 2.0
   64    68    75    83   0.32050  1.0 3.0
   68    74    80    81   0.03000  1.0 3.0
   68    74    80    82   0.03000  1.0 3.0
   68    74    80    89  -2.65550  1.0 1.0
   68    74    80    89  -0.22350 -1.0 2.0
   68    74    80    89   0.24150  1.0 3.0
   68    75    83    84   0.03000  1.0 3.0
   68    75    83    85   0.03000  1.0 3.0
   68    75    83    93  -2.65550  1.0 1.0
   68    75    83    93  -0.22350 -1.0 2.0
   68    75    83    93   0.24150  1.0 3.0
   69    68    74    80   0.15000  1.0 3.0
   69    68    75    83   0.15000  1.0 3.0
   74    68    75    83   0.91800  1.0 1.0
   74    68    75    83   0.22900 -1.0 2.0
   74    68    75    83   0.32050  1.0 3.0
   74    80    89    90   0.23400  1.0 3.0
   74    80    89    91   0.23400  1.0 3.0
   74    80    89    92   0.23400  1.0 3.0
   81    80    89    90   0.15000  1.0 3.0
   81    80    89    91   0.15000  1.0 3.0
   81    80    89    92   0.15000  1.0 3.0
   82    80    89    90   0.15000  1.0 3.0
   82    80    89    91   0.15000  1.0 3.0
   82    80    89    92   0.15000  1.0 3.0
   75    68    74    80   0.91800  1.0 1.0
   75    68    74    80   0.22900 -1.0 2.0
   75    68    74    80   0.32050  1.0 3.0
   75    83    93    94   0.23400  1.0 3.0
   75    83    93    95   0.23400  1.0 3.0
   75    83    93    96   0.23400  1.0 3.0
   84    83    93    94   0.15000  1.0 3.0
   84    83    93    95   0.15000  1.0 3.0
   84    83    93    96   0.15000  1.0 3.0
   85    83    93    94   0.15000  1.0 3.0
   85    83    93    95   0.15000  1.0 3.0
   85    83    93    96   0.15000  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    41    37    38  10.50000 -1.0 2.0
   55    70    52    41   4.00000 -1.0 2.0
   58    56    55    52   1.10000 -1.0 2.0
   60    64    58    55   4.00000 -1.0 2.0
   65    61    60    58   1.10000 -1.0 2.0
   70    66    65    60   1.10000 -1.0 2.0
   65    39    70    52   4.00000 -1.0 2.0
   42    57    53    54  10.50000 -1.0 2.0
   62    86    59    57   4.00000 -1.0 2.0
   67    63    62    59   1.10000 -1.0 2.0
   71    73    67    62   4.00000 -1.0 2.0
   76    72    71    67   1.10000 -1.0 2.0
   86    77    76    71   1.10000 -1.0 2.0
   76    40    86    59   4.00000 -1.0 2.0
END
