* LIGAND DATABASE FILE (OPLS2005)
*
001     112   113    205    307     606
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02055   106.20748   -23.50704
    3     1 S   H    _H1_     3     1.02080    61.63058    79.31692
    4     1 S   H    _H2_     4     1.02153    50.66120  -124.64643
    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     1.08610   110.54789    58.78698
   26    24 S   HC   HB22    34     1.08612   109.94660   179.10082
   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   CT   _C15    36     1.84048    97.56333   161.83377
   34    33 S   HC   _H4_    37     1.09612   105.08080   -33.60590
   35    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   36    35 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   37    35 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   38    33 S   CT   _C16    38     1.54864   105.97560    80.04031
   39    38 S   HC   _H21    39     1.09394   108.47499    59.36843
   40    38 S   HC   _H22    40     1.09763   108.88144   -57.10148
   41    33 S   CT   _C14    79     1.56092   114.35297  -154.26189
   42    41 S   HC   _H20    80     1.09169   107.36057   -94.11230
   43    38 S   CT   _C17    41     1.52834   114.81354  -178.39124
   44    43 S   HC   _H23    42     1.09524   110.20482   -68.11196
   45    43 S   HC   _H24    43     1.09768   108.60278    47.74928
   46    41 S   CT   _C30    81     1.53454   116.22772    26.17066
   47    46 S   HC   _H42    82     1.08692   109.48710    59.77759
   48    46 S   HC   _H43    83     1.08658   109.51410   -60.26857
   49    46 S   HC   _H44    84     1.08688   109.49456   179.75531
   50    43 S   CT   _C18    44     1.53777   115.05664   169.46855
   51    50 S   HC   _H5_    45     1.10063   110.21064   -47.52508
   52    50 S   CT   _C19    46     1.54483   115.80842    79.05537
   53    52 S   HC   _H6_    47     1.09700   108.31951    60.27098
   54    50 S   OS   _O37   108     1.43950   106.42439  -161.93795
   55    52 S   CM   _C20    48     1.52012   116.03443   -65.16520
   56    52 S   OH   _O36   106     1.43627   107.47652   173.92120
   57    56 S   HO   _H38   107     0.96687   106.05499  -174.13863
   58    54 S   CT   _C29   109     1.41517   110.90226    80.00193
   59    58 S   HC   _H39   110     1.09265   109.46369  -179.98022
   60    58 S   HC   _H40   111     1.09215   109.51108    59.20771
   61    58 S   HC   _H41   112     1.09302   108.95071   -60.42290
   62    55 S   CM   _C21    49     1.35054   119.75168   121.75862
   63    62 S   HC   _H25    50     1.08667   117.40209     2.58111
   64    55 S   CT   _C28   102     1.50894   115.96942   -60.34495
   65    64 S   HC   _H35   103     1.08466   109.03536   -87.71582
   66    64 S   HC   _H36   104     1.08485   109.06289   152.05650
   67    64 S   HC   _H37   105     1.08546   109.03979    32.41701
   68    62 S   CT   _C22    51     1.51282   127.45331  -179.30283
   69    68 S   HC   _H7_    52     1.09585   108.63996    15.64245
   70    68 S   CT   _C23    53     1.55388   115.22870   133.03369
   71    70 S   HC   _H8_    54     1.11234   105.50505  -179.62361
   72    68 S   CT   _C27    98     1.53260   108.92330  -100.91098
   73    72 S   HC   _H32    99     1.08735   109.54456   -62.59816
   74    72 S   HC   _H33   100     1.08733   109.53537   177.49657
   75    72 S   HC   _H34   101     1.08654   109.55395    57.40229
   76    70 S   CT   _C24    55     1.54549   117.74594    60.55698
   77    76 S   HC   _H9_    56     1.09767   109.44556    32.44501
   78    70 S   OH   _O35    96     1.42931   109.77011   -67.51885
   79    78 S   HO   _H31    97     0.96874   106.24749   -59.99333
   80    76 S   CT   _C25    57     1.54117   116.22247   -93.68566
   81    80 S   HC   _H26    58     1.09313   110.42909    52.56879
   82    80 S   HC   _H27    59     1.09743   108.53057   -64.65884
   83    76 S   OS   _O34    91     1.43710   107.11863   146.75597
   84    80 S   CT   _C5_    60     1.54946   113.36503   175.92028
   85    84 S   HC   _H3_    61     1.09840   108.09557    49.20819
   86    83 S   CT   _C26    92     1.41529   110.97169   -74.71712
   87    86 S   HC   _H28    93     1.09276   109.55988   179.96044
   88    86 S   HC   _H29    94     1.09376   109.49975    59.18947
   89    86 S   HC   _H30    95     1.09233   108.97290   -60.38845
   90    84 S   CT   _C6_    62     1.54699   112.28458   165.19673
   91    90 S   HC   _H13    63     1.09893   108.96391   -60.17024
   92    90 S   HC   _H14    64     1.09796   109.00635  -173.84285
   93    84 S   CT   _C4_    87     1.53260   111.88555   -68.13074
   94    93 S   HC   _H10    88     1.08739   109.55559   -61.82853
   95    93 S   HC   _H11    89     1.08693   109.57524   178.10773
   96    93 S   HC   _H12    90     1.08723   109.56691    58.10401
   97    90 S   CA   _C7_    65     1.50994   116.34870    63.09755
   98    97 S   CA   _C8_    66     1.40487   120.34678   -91.51231
   99    98 S   HA   _H15    67     1.08382   118.12007    -2.21770
  100    98 S   CA   _C9_    68     1.39437   120.27122   179.67135
  101   100 S   CA   _C10    69     1.39928   120.00670     1.72646
  102   101 S   HA   _H16    70     1.08787   120.96264   179.09172
  103   100 S   NIP  _N4_    76     1.39968   122.80000   180.00000
  104   103 S   H    _H19    77     1.02361   115.33797  -166.90069
  105   101 S   CA   _C11    71     1.39357   119.98644    -1.42875
  106   103 S   CG   _C13    78     1.55637   131.18976    15.00640
  107    97 S   CA   _C12    72     1.40111   120.44358    89.17198
  108   107 S   HA   _H17    73     1.08729   120.08008    -0.17471
  109   105 S   OH   _O33    74     1.36102   119.99716  -179.56210
  110   109 S   HO   _H18    75     0.97091   110.24583  -179.96044
  111   106 S   OH   _O38    85     1.34486   115.64707  -160.43161
  112   111 S   HO   _H45    86     0.97428   111.77166     1.79471
  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
  17   8   2   1   1  13   6   5  12   7  10   5   4   6   3   2
   1  13   6  13   6   6  12   3   1   3   2   1   1  15   5   4
   2   1   1  13   8  15   7   5   2   1   1  15   7   3   1  14
   6   5   5  11   8   3   2   1   1  13   5   4   4   2   1   1
   9  10   4   9   9   4   5   2   4   2   3   1   1   1   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    41    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    43   106    41    42    46  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    43    44    45    50   103   106    41    42    46    47    48    49   111  
   38    39    40    43   106    41    42    46  
   36    37  
   37  
    0  
   39    40    43    44    45    50    51    52   106    41    42    46    54  
   40    43    44    45    50    41  
   43    44    45    50    41  
   42    46    47    48    49   111   112    43   100   103   104   106  
   46    47    48    49   111   103   106  
   44    45    50    51    52    53    55    56    54    58  
   45    50    51    52    54  
   50    51    52    54  
   47    48    49   111   103   106  
   48    49   106  
   49   106  
  106  
   51    52    53    55    62    64    56    57    54    58    59    60    61  
   52    53    55    56    54    58  
   53    55    62    63    68    64    65    66    67    56    57    54    58  
   55    62    64    56    57    54  
   58    59    60    61    55    56  
   62    63    68    69    70    72    64    65    66    67    56    57  
   57    62    64  
    0  
   59    60    61  
   60    61  
   61  
    0  
   63    68    69    70    71    76    78    72    73    74    75    64    65    66    67  
   68    69    70    72    64  
   65    66    67    68  
   66    67  
   67  
    0  
   69    70    71    76    77    80    83    78    79    72    73    74    75  
   70    71    76    78    72    73    74    75  
   71    76    77    80    81    82    84    83    86    78    79    72    73    74    75  
   76    77    80    83    78    79    72  
   73    74    75    76    78  
   74    75  
   75  
    0  
   77    80    81    82    84    85    90    93    83    86    87    88    89    78    79  
   80    81    82    84    83    86    78  
   79    80    83  
    0  
   81    82    84    85    90    91    92    97    93    94    95    96    83    86  
   82    84    85    90    93    83  
   84    85    90    93    83  
   86    87    88    89    84  
   85    90    91    92    97    98   107    93    94    95    96  
   90    91    92    97    93    94    95    96  
   87    88    89  
   88    89  
   89  
    0  
   91    92    97    98    99   100   105   107   108    93    94    95    96  
   92    97    98   107    93  
   97    98   107    93  
   94    95    96    97  
   95    96  
   96  
    0  
   98    99   100   101   105   107   108   109   103  
   99   100   101   102   105   107   108   103   104   106  
  100   101   107   103  
  101   102   105   107   109   103   104   106   111  
  102   105   107   108   109   110   103   104   106  
  105   107   109   103  
  104   106   111   112   105  
  106   111  
  107   108   109   110  
  111   112  
  108   109   110  
  109  
  110  
    0  
  112  
    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   0.275700   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   55   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   56   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   57   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   58   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   63   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   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   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   77   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   78   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   79   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   80   3.5000   0.0660  -0.120000   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   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   84   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   88   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   89   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   90   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   98   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   99   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  100   3.5500   0.0700   0.122500   2.5000   1.7750   0.001000000  -0.843144165
  101   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  102   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  103   3.2500   0.1700  -0.139000   2.2900   2.0360   0.003973653   1.685851020
  104   0.5000   0.0300   0.480000   0.9960   0.8600   0.030040813  -0.651083722
  105   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
  106   3.7500   0.1050   0.285800   2.0020   1.7750   0.023028004  -0.852763146
  107   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  108   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  109   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
  110   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
  111   3.1200   0.1700  -0.503000   1.7660   1.5600   0.021068034  -0.322181743
  112   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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    41   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    43   268.000  1.529
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    50   268.000  1.529
   50    51   340.000  1.090
   50    52   268.000  1.529
   50    54   320.000  1.410
   52    53   340.000  1.090
   52    55   317.000  1.510
   52    56   320.000  1.410
   55    62   549.000  1.340
   55    64   317.000  1.510
   62    63   340.000  1.080
   62    68   317.000  1.510
   68    69   340.000  1.090
   68    70   268.000  1.529
   68    72   268.000  1.529
   70    71   340.000  1.090
   70    76   268.000  1.529
   70    78   320.000  1.410
   76    77   340.000  1.090
   76    80   268.000  1.529
   76    83   320.000  1.410
   80    81   340.000  1.090
   80    82   340.000  1.090
   80    84   268.000  1.529
   84    85   340.000  1.090
   84    90   268.000  1.529
   84    93   268.000  1.529
   90    91   340.000  1.090
   90    92   340.000  1.090
   90    97   317.000  1.510
   97    98   469.000  1.400
   97   107   469.000  1.400
   98    99   367.000  1.080
   98   100   469.000  1.400
  100   101   469.000  1.400
  100   103   340.000  1.432
  101   102   367.000  1.080
  101   105   469.000  1.400
  105   107   469.000  1.400
  105   109   450.000  1.364
  107   108   367.000  1.080
  109   110   553.000  0.945
  103   104   490.000  1.015
  103   106   635.000  1.286
  106    41   290.000  1.488
  106   111   440.000  1.374
   41    42   340.000  1.090
   41    46   268.000  1.529
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    49   340.000  1.090
  111   112   553.000  0.945
   93    94   340.000  1.090
   93    95   340.000  1.090
   93    96   340.000  1.090
   83    86   320.000  1.410
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    89   340.000  1.090
   78    79   553.000  0.945
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    75   340.000  1.090
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   340.000  1.090
   56    57   553.000  0.945
   54    58   320.000  1.410
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   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    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    41    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    43    58.35000  112.70000
   33    41   106    70.00000  109.02000
   33    41    42    37.50000  110.70000
   33    41    46    58.35000  112.70000
   38    33    34    37.50000  110.70000
   38    43    44    37.50000  110.70000
   38    43    45    37.50000  110.70000
   38    43    50    58.35000  112.70000
   40    38    39    33.00000  107.80000
   43    38    39    37.50000  110.70000
   43    38    40    37.50000  110.70000
   43    50    51    37.50000  110.70000
   43    50    52    58.35000  112.70000
   43    50    54    50.00000  109.50000
   45    43    44    33.00000  107.80000
   50    43    44    37.50000  110.70000
   50    43    45    37.50000  110.70000
   50    52    53    37.50000  110.70000
   50    52    55    70.00000  112.02700
   50    52    56    50.00000  109.50000
   50    54    58    60.00000  109.50000
   52    50    51    37.50000  110.70000
   52    55    62    70.00000  124.00000
   52    55    64    65.00000  117.92700
   52    56    57    55.00000  108.50000
   55    52    53    35.00000  109.50000
   55    62    63    35.00000  120.00000
   55    62    68    70.00000  124.00000
   55    64    65    35.00000  109.50000
   55    64    66    35.00000  109.50000
   55    64    67    35.00000  109.50000
   62    68    69    35.00000  109.50000
   62    68    70    70.00000  112.02700
   62    68    72    70.00000  112.02700
   68    62    63    35.00000  117.00000
   68    70    71    37.50000  110.70000
   68    70    76    58.35000  112.70000
   68    70    78    50.00000  109.50000
   68    72    73    37.50000  110.70000
   68    72    74    37.50000  110.70000
   68    72    75    37.50000  110.70000
   70    68    69    37.50000  110.70000
   70    76    77    37.50000  110.70000
   70    76    80    58.35000  112.70000
   70    76    83    50.00000  109.50000
   70    78    79    55.00000  108.50000
   76    70    71    37.50000  110.70000
   76    80    81    37.50000  110.70000
   76    80    82    37.50000  110.70000
   76    80    84    58.35000  112.70000
   76    83    86    60.00000  109.50000
   80    76    77    37.50000  110.70000
   80    84    85    37.50000  110.70000
   80    84    90    58.35000  112.70000
   80    84    93    58.35000  112.70000
   82    80    81    33.00000  107.80000
   84    80    81    37.50000  110.70000
   84    80    82    37.50000  110.70000
   84    90    91    37.50000  110.70000
   84    90    92    37.50000  110.70000
   84    90    97    70.00000  112.17500
   84    93    94    37.50000  110.70000
   84    93    95    37.50000  110.70000
   84    93    96    37.50000  110.70000
   90    84    85    37.50000  110.70000
   90    97    98    70.00000  120.00000
   90    97   107    70.00000  120.00000
   92    90    91    33.00000  107.80000
   97    90    91    35.00000  109.50000
   97    90    92    35.00000  109.50000
   97    98    99    35.00000  120.00000
   97    98   100    63.00000  120.00000
   97   107   105    63.00000  120.00000
   97   107   108    35.00000  120.00000
   98   100   101    63.00000  120.00000
   98   100   103    70.00000  116.83300
  100    98    99    35.00000  120.00000
  100   101   102    35.00000  120.00000
  100   101   105    63.00000  120.00000
  100   103   104    45.00000  117.88000
  100   103   106    65.00000  127.86000
  101   105   107    63.00000  120.00000
  101   105   109    70.00000  120.00000
  105   101   102    35.00000  120.00000
  105   107   108    35.00000  120.00000
  105   109   110    35.00000  113.00000
  107    97    98    63.00000  120.00000
  109   105   107    70.00000  120.00000
  103   100   101    70.00000  116.83300
  103   106    41    70.00000  120.65200
  103   106   111   100.00000  117.62000
  106   103   104    45.00000  118.89500
  106    41    42    45.00000  109.33400
  106    41    46    70.00000  109.02000
  106   111   112    70.00000  105.55000
   41    33    34    37.50000  110.70000
   41    33    38    58.35000  112.70000
   41    46    47    37.50000  110.70000
   41    46    48    37.50000  110.70000
   41    46    49    37.50000  110.70000
   46    41    42    37.50000  110.70000
   48    46    47    33.00000  107.80000
   49    46    47    33.00000  107.80000
   49    46    48    33.00000  107.80000
  111   106    41    85.00000  110.80600
   93    84    85    37.50000  110.70000
   93    84    90    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
   83    76    77    35.00000  109.50000
   83    76    80    50.00000  109.50000
   83    86    87    35.00000  109.50000
   83    86    88    35.00000  109.50000
   83    86    89    35.00000  109.50000
   88    86    87    33.00000  107.80000
   89    86    87    33.00000  107.80000
   89    86    88    33.00000  107.80000
   78    70    71    35.00000  109.50000
   78    70    76    50.00000  109.50000
   72    68    69    37.50000  110.70000
   72    68    70    58.35000  112.70000
   74    72    73    33.00000  107.80000
   75    72    73    33.00000  107.80000
   75    72    74    33.00000  107.80000
   64    55    62    70.00000  124.00000
   66    64    65    33.00000  107.80000
   67    64    65    33.00000  107.80000
   67    64    66    33.00000  107.80000
   56    52    53    35.00000  109.50000
   56    52    55    90.00000  110.39200
   54    50    51    35.00000  109.50000
   54    50    52    50.00000  109.50000
   54    58    59    35.00000  109.50000
   54    58    60    35.00000  109.50000
   54    58    61    35.00000  109.50000
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    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    41   0.01700  1.0 1.0
   24    29    33    41  -0.23550 -1.0 2.0
   24    29    33    41   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    43   0.44750  1.0 1.0
   29    33    38    43  -0.17800 -1.0 2.0
   29    33    38    43   0.20200  1.0 3.0
   29    33    41   106   0.56750  1.0 1.0
   29    33    41   106  -0.07550 -1.0 2.0
   29    33    41   106   0.20000  1.0 3.0
   29    33    41    42   0.15000  1.0 3.0
   29    33    41    46   0.44750  1.0 1.0
   29    33    41    46  -0.17800 -1.0 2.0
   29    33    41    46   0.20200  1.0 3.0
   33    38    43    44   0.15000  1.0 3.0
   33    38    43    45   0.15000  1.0 3.0
   33    38    43    50   0.56750  1.0 1.0
   33    38    43    50  -0.07550 -1.0 2.0
   33    38    43    50   0.20000  1.0 3.0
   33    41    46    47   0.15000  1.0 3.0
   33    41    46    48   0.15000  1.0 3.0
   33    41    46    49   0.15000  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    43   0.15000  1.0 3.0
   34    33    41   106   0.15000  1.0 3.0
   34    33    41    42   0.15000  1.0 3.0
   34    33    41    46   0.15000  1.0 3.0
   38    33    41   106   0.34400  1.0 1.0
   38    33    41   106   0.09450 -1.0 2.0
   38    33    41   106   0.11100  1.0 3.0
   38    33    41    42   0.15000  1.0 3.0
   38    33    41    46   0.56750  1.0 1.0
   38    33    41    46  -0.07550 -1.0 2.0
   38    33    41    46   0.20000  1.0 3.0
   38    43    50    51   0.15000  1.0 3.0
   38    43    50    52   0.56750  1.0 1.0
   38    43    50    52  -0.07550 -1.0 2.0
   38    43    50    52   0.20000  1.0 3.0
   38    43    50    54   0.62750  1.0 1.0
   38    43    50    54  -0.30950 -1.0 2.0
   38    43    50    54   0.27300  1.0 3.0
   39    38    43    44   0.15000  1.0 3.0
   39    38    43    45   0.15000  1.0 3.0
   39    38    43    50   0.15000  1.0 3.0
   40    38    43    44   0.15000  1.0 3.0
   40    38    43    45   0.15000  1.0 3.0
   40    38    43    50   0.15000  1.0 3.0
   43    50    52    53   0.15000  1.0 3.0
   43    50    52    55   0.34400  1.0 1.0
   43    50    52    55   0.09450 -1.0 2.0
   43    50    52    55   0.11100  1.0 3.0
   43    50    52    56   0.86500  1.0 1.0
   43    50    52    56  -0.17500 -1.0 2.0
   43    50    52    56   0.20800  1.0 3.0
   43    50    54    58   0.06250  1.0 1.0
   43    50    54    58  -0.01100 -1.0 2.0
   43    50    54    58   0.28050  1.0 3.0
   44    43    50    51   0.15000  1.0 3.0
   44    43    50    52   0.15000  1.0 3.0
   44    43    50    54   0.23400  1.0 3.0
   45    43    50    51   0.15000  1.0 3.0
   45    43    50    52   0.15000  1.0 3.0
   45    43    50    54   0.23400  1.0 3.0
   50    52    55    62   0.09850  1.0 1.0
   50    52    55    62   0.15250 -1.0 2.0
   50    52    55    62  -0.50650  1.0 3.0
   50    52    55    64   0.46850  1.0 1.0
   50    52    55    64   0.08550 -1.0 2.0
   50    52    55    64   0.09800  1.0 3.0
   50    52    56    57  -0.11600  1.0 1.0
   50    52    56    57  -0.09450 -1.0 2.0
   50    52    56    57   0.21250  1.0 3.0
   50    54    58    59   0.37050  1.0 3.0
   50    54    58    60   0.37050  1.0 3.0
   50    54    58    61   0.37050  1.0 3.0
   51    50    52    53   0.15000  1.0 3.0
   51    50    52    55   0.15000  1.0 3.0
   51    50    52    56   0.23400  1.0 3.0
   51    50    54    58   0.37050  1.0 3.0
   52    50    54    58   0.06250  1.0 1.0
   52    50    54    58  -0.01100 -1.0 2.0
   52    50    54    58   0.28050  1.0 3.0
   52    55    62    63   7.00000 -1.0 2.0
   52    55    62    68   7.00000 -1.0 2.0
   52    55    64    65   0.34800  1.0 3.0
   52    55    64    66   0.34800  1.0 3.0
   52    55    64    67   0.34800  1.0 3.0
   53    52    55    62   0.00000  1.0 1.0
   53    52    55    64   0.34800  1.0 3.0
   53    52    56    57   0.19450  1.0 3.0
   55    52    56    57  -0.07800  1.0 1.0
   55    52    56    57  -0.21500 -1.0 2.0
   55    52    56    57  -0.03150  1.0 3.0
   55    62    68    69   0.00000  1.0 1.0
   55    62    68    70   0.09850  1.0 1.0
   55    62    68    70   0.15250 -1.0 2.0
   55    62    68    70  -0.50650  1.0 3.0
   55    62    68    72   0.09850  1.0 1.0
   55    62    68    72   0.15250 -1.0 2.0
   55    62    68    72  -0.50650  1.0 3.0
   62    55    64    65   0.00000  1.0 1.0
   62    55    64    66   0.00000  1.0 1.0
   62    55    64    67   0.00000  1.0 1.0
   62    68    70    71   0.15000  1.0 3.0
   62    68    70    76   0.34400  1.0 1.0
   62    68    70    76   0.09450 -1.0 2.0
   62    68    70    76   0.11100  1.0 3.0
   62    68    70    78   1.05650  1.0 1.0
   62    68    70    78   0.15600 -1.0 2.0
   62    68    70    78   0.53150  1.0 3.0
   62    68    72    73   0.15000  1.0 3.0
   62    68    72    74   0.15000  1.0 3.0
   62    68    72    75   0.15000  1.0 3.0
   63    62    68    69   0.33100  1.0 3.0
   63    62    68    70   0.00000  1.0 1.0
   63    62    68    72   0.00000  1.0 1.0
   68    70    76    77   0.15000  1.0 3.0
   68    70    76    80   0.56750  1.0 1.0
   68    70    76    80  -0.07550 -1.0 2.0
   68    70    76    80   0.20000  1.0 3.0
   68    70    76    83   0.62750  1.0 1.0
   68    70    76    83  -0.30950 -1.0 2.0
   68    70    76    83   0.27300  1.0 3.0
   68    70    78    79  -0.11600  1.0 1.0
   68    70    78    79  -0.09450 -1.0 2.0
   68    70    78    79   0.21250  1.0 3.0
   69    68    70    71   0.15000  1.0 3.0
   69    68    70    76   0.15000  1.0 3.0
   69    68    70    78   0.23400  1.0 3.0
   69    68    72    73   0.15000  1.0 3.0
   69    68    72    74   0.15000  1.0 3.0
   69    68    72    75   0.15000  1.0 3.0
   70    68    72    73   0.15000  1.0 3.0
   70    68    72    74   0.15000  1.0 3.0
   70    68    72    75   0.15000  1.0 3.0
   70    76    80    81   0.15000  1.0 3.0
   70    76    80    82   0.15000  1.0 3.0
   70    76    80    84   0.56750  1.0 1.0
   70    76    80    84  -0.07550 -1.0 2.0
   70    76    80    84   0.20000  1.0 3.0
   70    76    83    86   0.06250  1.0 1.0
   70    76    83    86  -0.01100 -1.0 2.0
   70    76    83    86   0.28050  1.0 3.0
   71    70    76    77   0.15000  1.0 3.0
   71    70    76    80   0.15000  1.0 3.0
   71    70    76    83   0.23400  1.0 3.0
   71    70    78    79   0.19450  1.0 3.0
   76    70    78    79  -0.11600  1.0 1.0
   76    70    78    79  -0.09450 -1.0 2.0
   76    70    78    79   0.21250  1.0 3.0
   76    80    84    85   0.15000  1.0 3.0
   76    80    84    90   0.56750  1.0 1.0
   76    80    84    90  -0.07550 -1.0 2.0
   76    80    84    90   0.20000  1.0 3.0
   76    80    84    93   0.56750  1.0 1.0
   76    80    84    93  -0.07550 -1.0 2.0
   76    80    84    93   0.20000  1.0 3.0
   76    83    86    87   0.37050  1.0 3.0
   76    83    86    88   0.37050  1.0 3.0
   76    83    86    89   0.37050  1.0 3.0
   77    76    80    81   0.15000  1.0 3.0
   77    76    80    82   0.15000  1.0 3.0
   77    76    80    84   0.15000  1.0 3.0
   77    76    83    86   0.37050  1.0 3.0
   80    76    83    86   0.06250  1.0 1.0
   80    76    83    86  -0.01100 -1.0 2.0
   80    76    83    86   0.28050  1.0 3.0
   80    84    90    91   0.15000  1.0 3.0
   80    84    90    92   0.15000  1.0 3.0
   80    84    90    97  -0.03700  1.0 1.0
   80    84    90    97   0.37200 -1.0 2.0
   80    84    90    97  -0.47300  1.0 3.0
   80    84    93    94   0.15000  1.0 3.0
   80    84    93    95   0.15000  1.0 3.0
   80    84    93    96   0.15000  1.0 3.0
   81    80    84    85   0.15000  1.0 3.0
   81    80    84    90   0.15000  1.0 3.0
   81    80    84    93   0.15000  1.0 3.0
   82    80    84    85   0.15000  1.0 3.0
   82    80    84    90   0.15000  1.0 3.0
   82    80    84    93   0.15000  1.0 3.0
   84    90    97    98   0.04150 -1.0 2.0
   84    90    97   107   0.04150 -1.0 2.0
   85    84    90    91   0.15000  1.0 3.0
   85    84    90    92   0.15000  1.0 3.0
   85    84    90    97   0.43200  1.0 3.0
   85    84    93    94   0.15000  1.0 3.0
   85    84    93    95   0.15000  1.0 3.0
   85    84    93    96   0.15000  1.0 3.0
   90    84    93    94   0.15000  1.0 3.0
   90    84    93    95   0.15000  1.0 3.0
   90    84    93    96   0.15000  1.0 3.0
   90    97    98    99   3.62500 -1.0 2.0
   90    97    98   100   3.62500 -1.0 2.0
   90    97   107   105   3.62500 -1.0 2.0
   90    97   107   108   3.62500 -1.0 2.0
   91    90    97    98   0.00000  1.0 1.0
   91    90    97   107   0.00000  1.0 1.0
   92    90    97    98   0.00000  1.0 1.0
   92    90    97   107   0.00000  1.0 1.0
   97    98   100   101   3.62500 -1.0 2.0
   97    98   100   103   3.62500 -1.0 2.0
   98    97   107   105   3.62500 -1.0 2.0
   98    97   107   108   3.62500 -1.0 2.0
   98   100   101   102   3.62500 -1.0 2.0
   98   100  -101   105   3.62500 -1.0 2.0
   98   100   103   104   1.00000 -1.0 2.0
   98   100   103   106   1.00000 -1.0 2.0
   99    98   100   101   3.62500 -1.0 2.0
   99    98   100   103   3.62500 -1.0 2.0
  100   101   105   107   3.62500 -1.0 2.0
  100   101   105   109   3.62500 -1.0 2.0
  100   103   106    41   2.00000 -1.0 2.0
  100   103   106   111   2.00000 -1.0 2.0
  101   100   103   104   1.00000 -1.0 2.0
  101   100   103   106   1.00000 -1.0 2.0
  101   105  -107    97   3.62500 -1.0 2.0
  101   105   107   108   3.62500 -1.0 2.0
  101   105   109   110   0.84100 -1.0 2.0
  102   101   105   107   3.62500 -1.0 2.0
  102   101   105   109   3.62500 -1.0 2.0
  107    97    98    99   3.62500 -1.0 2.0
  107    97   -98   100   3.62500 -1.0 2.0
  107   105   109   110   0.84100 -1.0 2.0
  109   105   107    97   3.62500 -1.0 2.0
  109   105   107   108   3.62500 -1.0 2.0
  103   100   101   102   3.62500 -1.0 2.0
  103   100   101   105   3.62500 -1.0 2.0
  103   106    41    33   0.00000  1.0 1.0
  103   106    41    42   0.00000  1.0 1.0
  103   106    41    46   0.00000  1.0 1.0
  103   106   111   112   1.50000 -1.0 2.0
  104   103   106    41   2.00000 -1.0 2.0
  104   103   106   111   2.00000 -1.0 2.0
  106    41    46    47   0.15000  1.0 3.0
  106    41    46    48   0.15000  1.0 3.0
  106    41    46    49   0.15000  1.0 3.0
   41    33    38    39   0.15000  1.0 3.0
   41    33    38    40   0.15000  1.0 3.0
   41    33    38    43   0.56750  1.0 1.0
   41    33    38    43  -0.07550 -1.0 2.0
   41    33    38    43   0.20000  1.0 3.0
   41   106   111   112   1.50000 -1.0 2.0
   42    41    46    47   0.15000  1.0 3.0
   42    41    46    48   0.15000  1.0 3.0
   42    41    46    49   0.15000  1.0 3.0
  111   106    41    33   0.00000  1.0 1.0
  111   106    41    42   0.00000  1.0 1.0
  111   106    41    46   0.00000  1.0 1.0
   93    84    90    91   0.15000  1.0 3.0
   93    84    90    92   0.15000  1.0 3.0
   93    84    90    97  -0.03700  1.0 1.0
   93    84    90    97   0.37200 -1.0 2.0
   93    84    90    97  -0.47300  1.0 3.0
   83    76    80    81   0.23400  1.0 3.0
   83    76    80    82   0.23400  1.0 3.0
   83    76    80    84   0.62750  1.0 1.0
   83    76    80    84  -0.30950 -1.0 2.0
   83    76    80    84   0.27300  1.0 3.0
   78    70    76    77   0.23400  1.0 3.0
   78    70    76    80   0.86500  1.0 1.0
   78    70    76    80  -0.17500 -1.0 2.0
   78    70    76    80   0.20800  1.0 3.0
   78    70    76    83   3.69350  1.0 1.0
   78    70    76    83  -1.82950 -1.0 2.0
   72    68    70    71   0.15000  1.0 3.0
   72    68    70    76   0.56750  1.0 1.0
   72    68    70    76  -0.07550 -1.0 2.0
   72    68    70    76   0.20000  1.0 3.0
   72    68    70    78   0.86500  1.0 1.0
   72    68    70    78  -0.17500 -1.0 2.0
   72    68    70    78   0.20800  1.0 3.0
   64    55    62    63   7.00000 -1.0 2.0
   64    55    62    68   7.00000 -1.0 2.0
   56    52    55    62   0.67800  1.0 1.0
   56    52    55    62   0.47050 -1.0 2.0
   56    52    55    62  -0.62500  1.0 3.0
   56    52    55    64   0.18000  1.0 1.0
   56    52    55    64   0.16450 -1.0 2.0
   56    52    55    64   0.04450  1.0 3.0
   54    50    52    53   0.23400  1.0 3.0
   54    50    52    55   0.61850  1.0 1.0
   54    50    52    55  -0.22750 -1.0 2.0
   54    50    52    55   0.15300  1.0 3.0
   54    50    52    56   3.69350  1.0 1.0
   54    50    52    56  -1.82950 -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
   52    64    55    62   1.10000 -1.0 2.0
   68    63    62    55   1.10000 -1.0 2.0
   98   107    97    90   4.00000 -1.0 2.0
  100    99    98    97   1.10000 -1.0 2.0
  101   103   100    98   4.00000 -1.0 2.0
  105   102   101   100   1.10000 -1.0 2.0
  107   109   105   101   4.00000 -1.0 2.0
  105   108   107    97   1.10000 -1.0 2.0
  100   104   103   106   1.00000 -1.0 2.0
   41   111   106   103  10.50000 -1.0 2.0
END
