* LIGAND DATABASE FILE (OPLS2005)
*
001     121   125    226    353     651
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02076   102.50558    13.34433
    3     1 S   H    _H1_     3     1.02094    40.62860   117.55160
    4     1 S   H    _H2_     4     1.02093    73.29228   -92.68836
    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     1.08638   110.54412    58.84088
   26    24 S   HC   HB22    34     1.08641   109.88695   179.05581
   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   _C19    36     1.82119    98.16583  -158.17580
   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   C5BC _C15    37     1.47549   109.96124  -160.03735
   38    33 S   CT   _C18    84     1.57198   111.36224   -48.61933
   39    38 S   HC   _H3_    85     1.09752   111.77469    18.38936
   40    33 S   OH   _O34   120     1.41772   111.01022    77.52493
   41    40 S   HO   _H21   121     0.97143   106.99310   -57.74791
   42    37 S   C5BC _C14    38     1.42806   140.08958   -72.75536
   43    38 S   CO4  _C20    86     1.50531   111.88282   136.46973
   44    43 S   O    _O35    87     1.22343   124.03043  -121.79132
   45    42 S   C5A  _C13    39     1.47922   103.49030  -178.25639
   46    43 S   OS   _O36    88     1.36376   109.53333    58.28564
   47    42 S   CT   _C38   116     1.47133   127.58060     1.30881
   48    47 S   HC   _H40   117     1.09843   110.91131   179.96044
   49    47 S   HC   _H41   118     1.09753   110.95015    60.30809
   50    47 S   HC   _H42   119     1.09737   110.88922   -59.83717
   51    45 S   NA   _N5_    40     1.29318   110.86727     0.59050
   52    51 S   H    _H19    41     1.01778   128.92238   179.22570
   53    46 S   CT   _C21    89     1.43120   115.42082   180.00000
   54    53 S   HC   _H22    90     1.09240   109.50867   179.96574
   55    53 S   HC   _H23    91     1.09273   109.52576    59.14634
   56    53 S   HC   _H24    92     1.09258   108.96794   -60.46348
   57    45 S   CT   _C12    93     1.48322   128.18134  -179.90309
   58    57 S   HC   _H17    94     1.09362   110.67206    -0.06853
   59    57 S   HC   _H18    95     1.09445   110.69619  -121.71790
   60    37 S   C5A  _C16    42     1.33523   113.75214   109.42712
   61    57 S   C5A  _C7_    96     1.48999   107.79420   119.47339
   62    60 S   CT   _C17    43     1.47368   114.04514     0.41825
   63    62 S   HC   _H20    44     1.09451   112.10508   128.73987
   64    61 S   C5BC _C6_    97     1.35142   130.25657   119.62058
   65    62 S   CD   _C22    45     1.49672   109.30509  -110.35493
   66    64 S   C5BC _C9_    98     1.47308   107.24125   180.00000
   67    64 S   CT   _C5_   109     1.48652   129.89049     0.07402
   68    67 S   HC   _H10   110     1.09616   108.75854    31.36412
   69    67 S   HC   _H11   111     1.09530   108.47743   148.87088
   70    65 S   CT   _C33    46     1.50820   121.33701   177.21407
   71    70 S   HC   _H6_    47     1.09550   110.26806   -49.68372
   72    66 S   C5A  _C8_    99     1.34707   106.52966     0.00000
   73    66 S   CT   _C10   105     1.48599   122.95556   179.93744
   74    73 S   HC   _H13   106     1.09180   110.13219    90.03223
   75    73 S   HC   _H14   107     1.09286   110.23226   -30.13273
   76    73 S   HC   _H15   108     1.09247   110.16599  -149.79037
   77    67 S   CT   _C4_   112     1.51671   110.68283   -90.02845
   78    77 S   HC   _H7_   113     1.09404   110.66903   -59.50367
   79    77 S   HC   _H8_   114     1.09498   110.93356  -179.74056
   80    77 S   HC   _H9_   115     1.09557   110.97689    60.70638
   81    70 S   CT   _C32    48     1.53269   100.21511  -168.81234
   82    81 S   HC   _H5_    49     1.09686   111.61392  -135.33434
   83    70 S   CT   _C34    75     1.52433   110.24436    72.27459
   84    83 S   HC   _H33    76     1.08797   108.14838   -59.96155
   85    83 S   HC   _H34    77     1.08919   106.98762    56.10636
   86    61 S   NA   _N4_   100     1.40390   120.76417   -60.41326
   87    86 S   H    _H12   101     1.01731   126.17257     0.07402
   88    72 S   CO4  _C11   102     1.45499   127.42955   179.98022
   89    88 S   O    _O33   103     1.23025   122.92698   179.87489
   90    88 S   HC   _H16   104     1.10619   115.57532     0.00000
   91    81 S   CM   _C23    50     1.50902   101.43834   -16.50981
   92    81 S   CT   _C37    71     1.52816   111.64444   102.14880
   93    92 S   HC   _H37    72     1.08901   109.73840   -56.14797
   94    92 S   HC   _H38    73     1.08850   109.82530  -176.13446
   95    92 S   HC   _H39    74     1.08854   109.79748    63.83362
   96    83 S   CT   _C35    78     1.51591   111.70146   176.34494
   97    96 S   HC   _H35    79     1.09763   107.54794  -179.31101
   98    96 S   HC   _H36    80     1.09661   110.20289   -62.94481
   99    65 S   NI   _N6_    51     1.29640   122.50107    -4.97689
  100    91 S   CM   _C24    52     1.33864   124.35595  -160.58268
  101   100 S   HC   _H25    53     1.08519   118.74430     0.05595
  102    96 S   CO3  _C36    81     1.53291   116.91861    61.55224
  103   102 S   O2Z  _O39    82     1.26194   116.51479  -150.03096
  104   102 S   O2Z  _O38    83     1.26520   114.19883    29.25343
  105   100 S   CT   _C25    54     1.49195   123.99566   179.96044
  106   105 S   HC   _H4_    55     1.09380   111.08953     0.03956
  107   105 S   CM   _C26    56     1.50190   114.53338  -127.90325
  108   107 S   CM   _C27    57     1.34485   112.61240  -116.35890
  109   107 S   CT   _C31    67     1.49470   119.76523    65.91365
  110   109 S   HC   _H30    68     1.08931   109.73397   -92.57662
  111   109 S   HC   _H31    69     1.08960   109.79496   147.20701
  112   109 S   HC   _H32    70     1.08979   109.75536    27.56034
  113   108 S   C    _C28    58     1.48379   106.67721    -0.28046
  114   113 S   O    _O37    59     1.21983   125.38652  -179.75371
  115   108 S   CM   _C29    62     1.42821   130.06971  -179.40719
  116   115 S   HC   _H27    63     1.09812   120.26884   140.02810
  117   105 S   N    _N7_    60     1.43668   108.91841   119.63174
  118   117 S   H    _H26    61     1.01582   123.66818   -59.78784
  119   115 S   CM   _C30    64     1.35038   120.11321   -40.00091
  120   119 S   HC   _H28    65     1.08434   121.08500   179.97202
  121   119 S   HC   _H29    66     1.08490   121.26178     0.08847
  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
  16   2   1   1  18  15   8   5   1  13  10   3  14   5   6   2
   1   1   9   3   3   2   1   1  10   4   3   5  11   8   3  16
  12  14   9   5   4  17   9   9   5   2   1   1   3   2   1   1
  14   8  11   5   4   4   1   2   1   1  11   5   2   1   1   5
   4   3   3   9   4   2   1   1  12   6  12  13   6   2   1   1
   6   3   5   3   1   1   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    38    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    42    60    62    38    39    43    40    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    42    45    51    60    62    63    65    38    39    43    44    46    47    40    41  
   35    36  
   36  
    0  
   42    45    51    52    60    62    63    65    38    39    43    57    47    48    49    50    40    41  
   39    43    44    46    53    40    41    42    51    60    62    63    65    70    99  
   43    44    46    40    60    62    63    65  
   41    42    43    60    62  
    0  
   45    51    52    60    62    57    58    59    61    47    48    49    50  
   44    46    53    54    55    56    60    62    63    65  
   46    53    62  
   51    52    60    62    57    58    59    61    64    86    47    48    49    50  
   53    54    55    56    62  
   48    49    50    51    57    60  
   49    50  
   50  
    0  
   52    60    62    63    65    57    58    59    61  
   60    62    57  
   54    55    56  
   55    56  
   56  
    0  
   58    59    61    64    66    72    86    87    67    60  
   59    61    64    86  
   61    64    86  
   62    63    65    70    99  
   64    66    72    86    87    88    73    67    68    69    77  
   63    65    70    71    81    91    99    83  
   65    70    99  
   66    72    86    87    88    73    74    75    76    67    68    69    77    78    79    80  
   70    71    81    82    91    99   100    92    83    84    85    96  
   72    86    87    88    89    90    73    74    75    76    67    68    69    77  
   68    69    77    78    79    80    72    73    86  
   69    77    78    79    80  
   77    78    79    80  
   71    81    82    91    99   100    92    93    94    95    83    84    85    96    97    98   102  
   81    82    91    99    92    83    84    85    96  
   86    87    88    89    90    73    74    75    76  
   74    75    76    86    88  
   75    76  
   76  
    0  
   78    79    80  
   79    80  
   80  
    0  
   82    91    99   100   101   105    92    93    94    95    83    84    85    96  
   91    99   100    92    93    94    95    83  
   84    85    96    97    98   102   103   104    91    92    99  
   85    96    97    98   102  
   96    97    98   102  
   87    88    89    90  
   88  
   89    90  
   90  
    0  
   99   100   101   105   106   107   117    92    93    94    95  
   93    94    95    99   100  
   94    95  
   95  
    0  
   97    98   102   103   104  
   98   102   103   104  
  102   103   104  
  100   101   105  
  101   105   106   107   108   113   117   118   109  
  105   106   107   117  
  103   104  
  104  
    0  
  106   107   108   113   114   117   118   115   109   110   111   112  
  107   108   113   117   118   109  
  108   113   114   117   118   115   116   119   109   110   111   112  
  113   114   117   118   115   116   119   120   121   109   110   111   112  
  110   111   112   113   115   117  
  111   112  
  112  
    0  
  114   117   118   115   116   119  
  117   118   115  
  116   119   120   121   117  
  119   120   121  
  118  
    0  
  120   121  
  121  
    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   0.547500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0700  -0.146000   2.5000   1.7750   0.001000000  -0.843144165
   38   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   40   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   41   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   42   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   43   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   45   3.5500   0.0700  -0.163000   2.0020   1.7750   0.001000000  -0.843144165
   46   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   47   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.2500   0.1700  -0.239000   1.8650   1.6500   0.001000000  -0.511443539
   52   0.5000   0.0300   0.317000   0.9960   0.8600   0.030040813  -0.651083722
   53   3.5000   0.0660   0.160000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   55   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   56   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   57   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5500   0.0700  -0.163000   2.5000   1.7750   0.001000000  -0.843144165
   61   3.5500   0.0700  -0.163000   2.0020   1.7750   0.001000000  -0.843144165
   62   3.5000   0.0660   0.131100   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   65   3.7500   0.1050   0.317500   2.0020   1.7750   0.023028004  -0.852763146
   66   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   67   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5000   0.0660  -0.023900   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5500   0.0700  -0.123000   2.0020   1.7750   0.001000000  -0.843144165
   73   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   3.5000   0.0660  -0.120000   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   3.2500   0.1700  -0.239000   1.8650   1.6500   0.001000000  -0.511443539
   87   0.5000   0.0300   0.317000   0.9960   0.8600   0.030040813  -0.651083722
   88   3.7500   0.1050   0.565000   2.1120   1.8750   0.001000000  -0.126889456
   89   2.9600   0.2100  -0.450000   1.6780   1.4800   0.001000000  -0.126889456
   90   2.4200   0.0150   0.000000   1.3810   1.2100   0.008598240   0.268726247
   91   3.5500   0.0760   0.122500   2.0020   1.7750   0.023028004  -0.852763146
   92   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   98   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   99   3.2800   0.1700  -0.512200   1.8540   1.6400   0.005000000   0.000000000
  100   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
  101   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  102   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
  103   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
  104   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
  105   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
  106   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
  107   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
  108   3.5500   0.0760  -0.056700   2.0020   1.7750   0.023028004  -0.852763146
  109   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  112   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  113   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
  114   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
  115   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
  116   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  117   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
  118   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
  119   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
  120   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  121   2.4200   0.0300   0.115000   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   222.000  1.810
   33    37   285.000  1.502
   33    38   268.000  1.529
   33    40   320.000  1.410
   37    42   469.000  1.424
   37    60   546.000  1.367
   42    45   546.000  1.367
   42    47   285.000  1.502
   45    51   427.000  1.381
   45    57   295.000  1.489
   51    52   434.000  1.010
   51    60   427.000  1.381
   60    62   295.000  1.489
   62    63   340.000  1.090
   62    65   270.000  1.508
   62    38   268.000  1.529
   65    70   270.000  1.508
   65    99   500.000  1.261
   70    71   340.000  1.090
   70    81   268.000  1.529
   70    83   268.000  1.529
   81    82   340.000  1.090
   81    91   317.000  1.510
   81    92   268.000  1.529
   91    99   405.000  1.380
   91   100   549.000  1.340
  100   101   340.000  1.080
  100   105   317.000  1.510
  105   106   340.000  1.090
  105   107   317.000  1.510
  105   117   337.000  1.449
  107   108   549.000  1.340
  107   109   317.000  1.510
  108   113   410.000  1.444
  108   115   380.000  1.444
  113   114   570.000  1.229
  113   117   490.000  1.335
  117   118   434.000  1.010
  115   116   340.000  1.080
  115   119   549.000  1.340
  119   120   340.000  1.080
  119   121   340.000  1.080
  109   110   340.000  1.090
  109   111   340.000  1.090
  109   112   340.000  1.090
   92    93   340.000  1.090
   92    94   340.000  1.090
   92    95   340.000  1.090
   83    84   340.000  1.090
   83    85   340.000  1.090
   83    96   268.000  1.529
   96    97   340.000  1.090
   96    98   340.000  1.090
   96   102   317.000  1.522
  102   103   656.000  1.250
  102   104   656.000  1.250
   38    39   340.000  1.090
   38    43   317.000  1.522
   43    44   570.000  1.229
   43    46   214.000  1.327
   46    53   320.000  1.410
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   340.000  1.090
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    61   295.000  1.489
   61    64   546.000  1.367
   61    86   427.000  1.381
   64    66   469.000  1.424
   64    67   285.000  1.502
   66    72   546.000  1.367
   66    73   285.000  1.502
   72    86   427.000  1.381
   72    88   335.000  1.450
   86    87   434.000  1.010
   88    89   570.000  1.229
   88    90   340.000  1.090
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    76   340.000  1.090
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    77   268.000  1.529
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    80   340.000  1.090
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    50   340.000  1.090
   40    41   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    80.00000  109.48900
   29    33    38    75.00000  111.63000
   29    33    40    85.00000  114.68000
   33    37    42    60.00000  130.00000
   33    37    60    60.00000  130.00000
   33    38    62    58.35000  112.70000
   33    38    39    37.50000  110.70000
   33    38    43    63.00000  111.10000
   33    40    41    55.00000  108.50000
   37    42    45    70.00000  107.30000
   37    42    47    60.00000  130.00000
   37    60    51    70.00000  107.70000
   37    60    62    50.00000  133.50000
   42    45    51    70.00000  107.70000
   42    45    57    50.00000  133.50000
   42    47    48    35.00000  109.50000
   42    47    49    35.00000  109.50000
   42    47    50    35.00000  109.50000
   45    51    52    35.00000  120.00000
   45    51    60    70.00000  109.80000
   45    57    58    45.00000  110.47400
   45    57    59    45.00000  110.47400
   45    57    61    70.00000  112.04700
   51    60    62    65.00000  122.56900
   60    37    42    70.00000  107.30000
   60    51    52    35.00000  120.00000
   60    62    63    45.00000  110.47400
   60    62    65    70.00000  112.40000
   60    62    38    70.00000  113.44400
   62    65    70    65.00000  114.98000
   62    65    99    65.00000  122.10100
   62    38    39    37.50000  110.70000
   62    38    43    63.00000  111.10000
   65    62    63    45.00000  109.49600
   65    70    71    45.00000  109.49600
   65    70    81    70.00000  111.76100
   65    70    83    70.00000  111.76100
   65    99    91    75.00000  115.77100
   70    81    82    37.50000  110.70000
   70    81    91    70.00000  112.02700
   70    81    92    58.35000  112.70000
   70    83    84    37.50000  110.70000
   70    83    85    37.50000  110.70000
   70    83    96    58.35000  112.70000
   81    70    71    37.50000  110.70000
   81    91    99    65.00000  119.96000
   81    91   100    70.00000  124.00000
   81    92    93    37.50000  110.70000
   81    92    94    37.50000  110.70000
   81    92    95    37.50000  110.70000
   91    81    82    35.00000  109.50000
   91   100   101    35.00000  120.00000
   91   100   105    70.00000  124.00000
   99    65    70    65.00000  122.10100
  100    91    99    70.00000  120.83400
  100   105   106    35.00000  109.50000
  100   105   107    70.00000  110.12100
  100   105   117    75.00000  110.78400
  105   100   101    35.00000  117.00000
  105   107   108    70.00000  124.00000
  105   107   109    65.00000  117.92700
  105   117   113    50.00000  121.90000
  105   117   118    38.00000  118.40000
  107   105   106    35.00000  109.50000
  107   108   113    70.00000  118.70000
  107   108   115    70.00000  123.01800
  107   109   110    35.00000  109.50000
  107   109   111    35.00000  109.50000
  107   109   112    35.00000  109.50000
  108   113   114    80.00000  125.30000
  108   113   117    80.00000  111.56200
  108   115   116    35.00000  120.00000
  108   115   119    70.00000  123.01800
  113   117   118    35.00000  119.80000
  117   105   106    35.00000  109.50000
  117   105   107    75.00000  110.78400
  117   113   114    80.00000  122.90000
  115   108   113    70.00000  118.70000
  115   119   120    35.00000  120.00000
  115   119   121    35.00000  120.00000
  119   115   116    35.00000  120.00000
  121   119   120    35.00000  117.00000
  109   107   108    70.00000  124.00000
  111   109   110    33.00000  107.80000
  112   109   110    33.00000  107.80000
  112   109   111    33.00000  107.80000
   92    81    82    37.50000  110.70000
   92    81    91    70.00000  112.02700
   94    92    93    33.00000  107.80000
   95    92    93    33.00000  107.80000
   95    92    94    33.00000  107.80000
   83    70    71    37.50000  110.70000
   83    70    81    58.35000  112.70000
   83    96    97    37.50000  110.70000
   83    96    98    37.50000  110.70000
   83    96   102    70.00000  109.69300
   85    83    84    33.00000  107.80000
   96    83    84    37.50000  110.70000
   96    83    85    37.50000  110.70000
   96   102   103    70.00000  117.00000
   96   102   104    70.00000  117.00000
   98    96    97    33.00000  107.80000
  102    96    97    35.00000  109.50000
  102    96    98    35.00000  109.50000
  104   102   103    80.00000  126.00000
   38    33    37    70.00000  112.17500
   38    62    63    37.50000  110.70000
   38    62    65    70.00000  111.76100
   38    43    44    80.00000  120.40000
   38    43    46    81.00000  111.40000
   43    38    39    35.00000  109.50000
   43    46    53    83.00000  116.90000
   46    43    44    83.00000  123.40000
   46    53    54    35.00000  109.50000
   46    53    55    35.00000  109.50000
   46    53    56    35.00000  109.50000
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    33.00000  107.80000
   57    45    51    65.00000  122.56900
   57    61    64    50.00000  133.50000
   57    61    86    65.00000  122.56900
   59    57    58    33.00000  107.80000
   61    57    58    45.00000  110.47400
   61    57    59    45.00000  110.47400
   61    64    66    70.00000  107.30000
   61    64    67    60.00000  130.00000
   61    86    72    70.00000  109.80000
   61    86    87    35.00000  120.00000
   64    66    72    70.00000  107.30000
   64    66    73    60.00000  130.00000
   64    67    68    35.00000  109.50000
   64    67    69    35.00000  109.50000
   64    67    77    70.00000  112.17500
   66    72    86    70.00000  107.70000
   66    72    88    55.00000  130.80000
   66    73    74    35.00000  109.50000
   66    73    75    35.00000  109.50000
   66    73    76    35.00000  109.50000
   72    86    87    35.00000  120.00000
   72    88    89    80.00000  122.40000
   72    88    90    35.00000  115.00000
   86    61    64    70.00000  107.70000
   88    72    86    70.00000  119.02500
   90    88    89    35.00000  123.00000
   73    66    72    60.00000  130.00000
   75    73    74    33.00000  107.80000
   76    73    74    33.00000  107.80000
   76    73    75    33.00000  107.80000
   67    64    66    60.00000  130.00000
   67    77    78    37.50000  110.70000
   67    77    79    37.50000  110.70000
   67    77    80    37.50000  110.70000
   69    67    68    33.00000  107.80000
   77    67    68    37.50000  110.70000
   77    67    69    37.50000  110.70000
   79    77    78    33.00000  107.80000
   80    77    78    33.00000  107.80000
   80    77    79    33.00000  107.80000
   47    42    45    60.00000  130.00000
   49    47    48    33.00000  107.80000
   50    47    48    33.00000  107.80000
   50    47    49    33.00000  107.80000
   40    33    37    90.00000  112.51600
   40    33    38    50.00000  109.50000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    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  -0.23050  1.0 1.0
   24    29    33    37   0.06200 -1.0 2.0
   24    29    33    37   0.47200  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    40   0.13850  1.0 1.0
   24    29    33    40  -1.34450 -1.0 2.0
   24    29    33    40   0.57400  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    42  -0.16000  1.0 1.0
   29    33    37    42  -0.03200 -1.0 2.0
   29    33    37    42   0.04500  1.0 3.0
   29    33    37    60  -0.16000  1.0 1.0
   29    33    37    60  -0.03200 -1.0 2.0
   29    33    37    60   0.04500  1.0 3.0
   29    33    38    62   0.44750  1.0 1.0
   29    33    38    62  -0.17800 -1.0 2.0
   29    33    38    62   0.20200  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    43   0.56750  1.0 1.0
   29    33    38    43  -0.07550 -1.0 2.0
   29    33    38    43   0.20000  1.0 3.0
   29    33    40    41   0.35600  1.0 1.0
   29    33    40    41  -0.10750 -1.0 2.0
   29    33    40    41  -0.54400  1.0 3.0
   33    37    42    45   3.62500 -1.0 2.0
   33    37    42    47   3.62500 -1.0 2.0
   33    37    60    51   3.62500 -1.0 2.0
   33    37   -60    62   3.62500 -1.0 2.0
   33    38    43    44   0.30150 -1.0 2.0
   33    38    43    46   0.36750  1.0 3.0
   37    33   -38    62  -0.03700  1.0 1.0
   37    33   -38    62   0.37200 -1.0 2.0
   37    33   -38    62  -0.47300  1.0 3.0
   37    33    38    39   0.43200  1.0 3.0
   37    33    38    43   0.56750  1.0 1.0
   37    33    38    43  -0.07550 -1.0 2.0
   37    33    38    43   0.20000  1.0 3.0
   37    33    40    41   0.31900  1.0 1.0
   37    33    40    41  -0.11800 -1.0 2.0
   37    33    40    41   0.38750  1.0 3.0
   37    42   -45    51   3.62500 -1.0 2.0
   37    42    45    57   3.62500 -1.0 2.0
   37    42    47    48   0.00000  1.0 1.0
   37    42    47    49   0.00000  1.0 1.0
   37    42    47    50   0.00000  1.0 1.0
   37    60    62    63   0.00000  1.0 1.0
   37    60    62    65   0.18050 -1.0 2.0
   37    60   -62    38   0.04150 -1.0 2.0
   42    37   -60    51   3.62500 -1.0 2.0
   42    37    60    62   3.62500 -1.0 2.0
   42    45    51    52   2.00000 -1.0 2.0
   42    45   -51    60   3.62500 -1.0 2.0
   42    45    57    58   0.00000  1.0 1.0
   42    45    57    59   0.00000  1.0 1.0
   42    45    57    61   0.04300 -1.0 2.0
   45    42    47    48   0.00000  1.0 1.0
   45    42    47    49   0.00000  1.0 1.0
   45    42    47    50   0.00000  1.0 1.0
   45    51   -60    37   3.62500 -1.0 2.0
   45    51    60    62   3.62500 -1.0 2.0
   45    57    61    64   0.04300 -1.0 2.0
   45    57    61    86   0.04300 -1.0 2.0
   51    45    57    58   0.00000  1.0 1.0
   51    45    57    59   0.00000  1.0 1.0
   51    45    57    61   0.04300 -1.0 2.0
   51    60    62    63   0.00000  1.0 1.0
   51    60    62    65   0.04300 -1.0 2.0
   51    60    62    38   0.39850  1.0 1.0
   51    60    62    38   0.06450 -1.0 2.0
   51    60    62    38   0.32400  1.0 3.0
   52    51    60    37   2.00000 -1.0 2.0
   52    51    60    62   2.00000 -1.0 2.0
   60    37   -42    45   3.62500 -1.0 2.0
   60    37    42    47   3.62500 -1.0 2.0
   60    62    65    70   0.00000  1.0 1.0
   60    62    65    99   0.00000  1.0 1.0
   60    62   -38    33  -0.03700  1.0 1.0
   60    62   -38    33   0.37200 -1.0 2.0
   60    62   -38    33  -0.47300  1.0 3.0
   60    62    38    39   0.43200  1.0 3.0
   60    62    38    43   0.56750  1.0 1.0
   60    62    38    43  -0.07550 -1.0 2.0
   60    62    38    43   0.20000  1.0 3.0
   62    65    70    71   0.00000  1.0 1.0
   62    65    70    81   0.46850  1.0 1.0
   62    65    70    81   0.08550 -1.0 2.0
   62    65    70    81   0.09800  1.0 3.0
   62    65    70    83   0.46850  1.0 1.0
   62    65    70    83   0.08550 -1.0 2.0
   62    65    70    83   0.09800  1.0 3.0
   62    65    99    91   6.00000 -1.0 2.0
   62    38    43    44   0.30150 -1.0 2.0
   62    38    43    46   0.36750  1.0 3.0
   63    62    65    70   0.00000  1.0 1.0
   63    62    65    99   0.00000  1.0 1.0
   63    62    38    33   0.15000  1.0 3.0
   63    62    38    39   0.15000  1.0 3.0
   63    62    38    43  -0.11250  1.0 3.0
   65    62    38    33   0.34400  1.0 1.0
   65    62    38    33   0.09450 -1.0 2.0
   65    62    38    33   0.11100  1.0 3.0
   65    62    38    39   0.15000  1.0 3.0
   65    62    38    43  -0.98800  1.0 1.0
   65    62    38    43   0.48800 -1.0 2.0
   65    62    38    43   0.76800  1.0 3.0
   65    70    81    82   0.15000  1.0 3.0
   65    70   -81    91   0.31000  1.0 1.0
   65    70   -81    91   0.14700 -1.0 2.0
   65    70   -81    91   0.07550  1.0 3.0
   65    70    81    92   0.34400  1.0 1.0
   65    70    81    92   0.09450 -1.0 2.0
   65    70    81    92   0.11100  1.0 3.0
   65    70    83    84   0.15000  1.0 3.0
   65    70    83    85   0.15000  1.0 3.0
   65    70    83    96   0.34400  1.0 1.0
   65    70    83    96   0.09450 -1.0 2.0
   65    70    83    96   0.11100  1.0 3.0
   70    65   -99    91   6.00000 -1.0 2.0
   70    81   -91    99   0.09700  1.0 1.0
   70    81   -91    99   0.15600 -1.0 2.0
   70    81   -91    99  -0.50800  1.0 3.0
   70    81    91   100   0.09850  1.0 1.0
   70    81    91   100   0.15250 -1.0 2.0
   70    81    91   100  -0.50650  1.0 3.0
   70    81    92    93   0.15000  1.0 3.0
   70    81    92    94   0.15000  1.0 3.0
   70    81    92    95   0.15000  1.0 3.0
   70    83    96    97   0.15000  1.0 3.0
   70    83    96    98   0.15000  1.0 3.0
   70    83    96   102  -1.63150  1.0 1.0
   70    83    96   102  -0.43550 -1.0 2.0
   70    83    96   102   0.24500  1.0 3.0
   71    70    81    82   0.15000  1.0 3.0
   71    70    81    91   0.15000  1.0 3.0
   71    70    81    92   0.15000  1.0 3.0
   71    70    83    84   0.15000  1.0 3.0
   71    70    83    85   0.15000  1.0 3.0
   71    70    83    96   0.15000  1.0 3.0
   81    70    83    84   0.15000  1.0 3.0
   81    70    83    85   0.15000  1.0 3.0
   81    70    83    96   0.56750  1.0 1.0
   81    70    83    96  -0.07550 -1.0 2.0
   81    70    83    96   0.20000  1.0 3.0
   81    91   -99    65   1.00000 -1.0 2.0
   81    91   100   101   7.00000 -1.0 2.0
   81    91   100   105   7.00000 -1.0 2.0
   82    81    91    99   0.00000  1.0 1.0
   82    81    91   100   0.00000  1.0 1.0
   82    81    92    93   0.15000  1.0 3.0
   82    81    92    94   0.15000  1.0 3.0
   82    81    92    95   0.15000  1.0 3.0
   91    81    92    93   0.15000  1.0 3.0
   91    81    92    94   0.15000  1.0 3.0
   91    81    92    95   0.15000  1.0 3.0
   91   100   105   106   0.00000  1.0 1.0
   91   100   105   107  -0.28300  1.0 1.0
   91   100   105   107   0.26700 -1.0 2.0
   91   100   105   107  -0.63300  1.0 3.0
   91   100   105   117   0.62150  1.0 1.0
   91   100   105   117   0.42850 -1.0 2.0
   91   100   105   117  -0.68200  1.0 3.0
   99    65    70    71   0.00000  1.0 1.0
   99    65   -70    81   0.00000  1.0 1.0
   99    65    70    83   0.00000  1.0 1.0
   99    91   100   101   7.00000 -1.0 2.0
   99    91   100   105   7.00000 -1.0 2.0
  100    91    99    65   1.00000 -1.0 2.0
  100   105   107   108  -0.28300  1.0 1.0
  100   105   107   108   0.26700 -1.0 2.0
  100   105   107   108  -0.63300  1.0 3.0
  100   105   107   109   0.09700  1.0 1.0
  100   105   107   109   0.15600 -1.0 2.0
  100   105   107   109  -0.50800  1.0 3.0
  100   105   117   113  -0.19250  1.0 1.0
  100   105   117   113  -0.00500 -1.0 2.0
  100   105   117   113   0.17000  1.0 3.0
  100   105   117   118   0.00000  1.0 1.0
  101   100   105   106   0.33100  1.0 3.0
  101   100   105   107   0.00000  1.0 1.0
  101   100   105   117   0.00000  1.0 1.0
  105   107  -108   113   7.00000 -1.0 2.0
  105   107   108   115   7.00000 -1.0 2.0
  105   107   109   110   0.34800  1.0 3.0
  105   107   109   111   0.34800  1.0 3.0
  105   107   109   112   0.34800  1.0 3.0
  106   105   107   108   0.00000  1.0 1.0
  106   105   107   109   0.34800  1.0 3.0
  106   105   117   113   0.00000  1.0 1.0
  106   105   117   118   0.00000  1.0 1.0
  107   105  -117   113  -0.19250  1.0 1.0
  107   105  -117   113  -0.00500 -1.0 2.0
  107   105  -117   113   0.17000  1.0 3.0
  107   105   117   118   0.00000  1.0 1.0
  107   108   113   114   1.00000 -1.0 2.0
  107   108  -113   117   0.49500  1.0 1.0
  107   108  -113   117   1.31600 -1.0 2.0
  107   108  -113   117  -0.02300  1.0 3.0
  107   108   115   116  -0.18600  1.0 3.0
  107   108   115   119   0.28850  1.0 1.0
  107   108   115   119   2.61350 -1.0 2.0
  107   108   115   119   0.78400  1.0 3.0
  108   107   109   110   0.00000  1.0 1.0
  108   107   109   111   0.00000  1.0 1.0
  108   107   109   112   0.00000  1.0 1.0
  108   113  -117   105   1.49850  1.0 1.0
  108   113  -117   105   1.53950 -1.0 2.0
  108   113   117   118   2.56700 -1.0 2.0
  108   115   119   120   7.00000 -1.0 2.0
  108   115   119   121   7.00000 -1.0 2.0
  113   108   115   116   0.00000  1.0 1.0
  113   108   115   119  -0.18600  1.0 3.0
  114   113   117   105   3.04450 -1.0 2.0
  114   113   117   118   2.45000 -1.0 2.0
  117   105  -107   108   0.62150  1.0 1.0
  117   105  -107   108   0.42850 -1.0 2.0
  117   105  -107   108  -0.68200  1.0 3.0
  117   105   107   109   0.09700  1.0 1.0
  117   105   107   109   0.15600 -1.0 2.0
  117   105   107   109  -0.50800  1.0 3.0
  115   108   113   114   1.00000 -1.0 2.0
  115   108   113   117   0.49500  1.0 1.0
  115   108   113   117   1.31600 -1.0 2.0
  115   108   113   117  -0.02300  1.0 3.0
  116   115   119   120   7.00000 -1.0 2.0
  116   115   119   121   7.00000 -1.0 2.0
  109   107   108   113   7.00000 -1.0 2.0
  109   107   108   115   7.00000 -1.0 2.0
   92    81    91    99   0.09700  1.0 1.0
   92    81    91    99   0.15600 -1.0 2.0
   92    81    91    99  -0.50800  1.0 3.0
   92    81    91   100   0.09850  1.0 1.0
   92    81    91   100   0.15250 -1.0 2.0
   92    81    91   100  -0.50650  1.0 3.0
   83    70    81    82   0.15000  1.0 3.0
   83    70    81    91   0.34400  1.0 1.0
   83    70    81    91   0.09450 -1.0 2.0
   83    70    81    91   0.11100  1.0 3.0
   83    70    81    92   0.56750  1.0 1.0
   83    70    81    92  -0.07550 -1.0 2.0
   83    70    81    92   0.20000  1.0 3.0
   83    96   102   103   0.41150 -1.0 2.0
   83    96   102   104   0.41150 -1.0 2.0
   84    83    96    97   0.15000  1.0 3.0
   84    83    96    98   0.15000  1.0 3.0
   84    83    96   102  -0.11250  1.0 3.0
   85    83    96    97   0.15000  1.0 3.0
   85    83    96    98   0.15000  1.0 3.0
   85    83    96   102  -0.11250  1.0 3.0
   97    96   102   103   0.00000  1.0 1.0
   97    96   102   104   0.00000  1.0 1.0
   98    96   102   103   0.00000  1.0 1.0
   98    96   102   104   0.00000  1.0 1.0
   38    33    37    42   0.04150 -1.0 2.0
   38    33   -37    60   0.04150 -1.0 2.0
   38    33    40    41  -0.11600  1.0 1.0
   38    33    40    41  -0.09450 -1.0 2.0
   38    33    40    41   0.21250  1.0 3.0
   38    62    65    70   0.46850  1.0 1.0
   38    62    65    70   0.08550 -1.0 2.0
   38    62    65    70   0.09800  1.0 3.0
   38    62    65    99   0.00000  1.0 1.0
   38    43    46    53   1.63150  1.0 1.0
   38    43    46    53   2.92000 -1.0 2.0
   39    38    43    44   0.00000  1.0 1.0
   39    38    43    46   0.00000  1.0 1.0
   43    46    53    54   0.08050  1.0 3.0
   43    46    53    55   0.08050  1.0 3.0
   43    46    53    56   0.08050  1.0 3.0
   44    43    46    53   3.00000 -1.0 2.0
   57    45    51    52   2.00000 -1.0 2.0
   57    45    51    60   3.62500 -1.0 2.0
   57    61    64    66   3.62500 -1.0 2.0
   57    61    64    67   3.62500 -1.0 2.0
   57    61    86    72   3.62500 -1.0 2.0
   57    61    86    87   2.00000 -1.0 2.0
   58    57    61    64   0.00000  1.0 1.0
   58    57    61    86   0.00000  1.0 1.0
   59    57    61    64   0.00000  1.0 1.0
   59    57    61    86   0.00000  1.0 1.0
   61    64   -66    72   3.62500 -1.0 2.0
   61    64    66    73   3.62500 -1.0 2.0
   61    64    67    68   0.00000  1.0 1.0
   61    64    67    69   0.00000  1.0 1.0
   61    64    67    77   0.04150 -1.0 2.0
   64    61   -86    72   3.62500 -1.0 2.0
   64    61    86    87   2.00000 -1.0 2.0
   64    66   -72    86   3.62500 -1.0 2.0
   64    66    72    88   3.62500 -1.0 2.0
   64    66    73    74   0.00000  1.0 1.0
   64    66    73    75   0.00000  1.0 1.0
   64    66    73    76   0.00000  1.0 1.0
   64    67    77    78   0.43200  1.0 3.0
   64    67    77    79   0.43200  1.0 3.0
   64    67    77    80   0.43200  1.0 3.0
   66    64    67    68   0.00000  1.0 1.0
   66    64    67    69   0.00000  1.0 1.0
   66    64    67    77   0.04150 -1.0 2.0
   66    72   -86    61   3.62500 -1.0 2.0
   66    72    86    87   2.00000 -1.0 2.0
   66    72    88    89   1.05000 -1.0 2.0
   66    72    88    90   0.56600 -1.0 2.0
   72    66    73    74   0.00000  1.0 1.0
   72    66    73    75   0.00000  1.0 1.0
   72    66    73    76   0.00000  1.0 1.0
   86    61   -64    66   3.62500 -1.0 2.0
   86    61    64    67   3.62500 -1.0 2.0
   86    72    88    89   1.85000 -1.0 2.0
   86    72    88    90   0.56600 -1.0 2.0
   88    72    86    61   3.62500 -1.0 2.0
   88    72    86    87   2.00000 -1.0 2.0
   73    66    72    86   3.62500 -1.0 2.0
   73    66    72    88   3.62500 -1.0 2.0
   67    64    66    72   3.62500 -1.0 2.0
   67    64    66    73   3.62500 -1.0 2.0
   68    67    77    78   0.15000  1.0 3.0
   68    67    77    79   0.15000  1.0 3.0
   68    67    77    80   0.15000  1.0 3.0
   69    67    77    78   0.15000  1.0 3.0
   69    67    77    79   0.15000  1.0 3.0
   69    67    77    80   0.15000  1.0 3.0
   47    42    45    51   3.62500 -1.0 2.0
   47    42    45    57   3.62500 -1.0 2.0
   40    33    37    42   0.14300 -1.0 2.0
   40    33    37    42   0.00300  1.0 3.0
   40    33    37    60   0.14300 -1.0 2.0
   40    33    37    60   0.00300  1.0 3.0
   40    33    38    62   0.86500  1.0 1.0
   40    33    38    62  -0.17500 -1.0 2.0
   40    33    38    62   0.20800  1.0 3.0
   40    33    38    39   0.23400  1.0 3.0
   40    33    38    43  -0.09450  1.0 1.0
   40    33    38    43  -1.12950 -1.0 2.0
   40    33    38    43   0.54000  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
   42    60    37    33   4.00000 -1.0 2.0
   45    47    42    37   4.00000 -1.0 2.0
   57    51    45    42   4.00000 -1.0 2.0
   52    45    51    60   1.00000 -1.0 2.0
   51    62    60    37   4.00000 -1.0 2.0
   62    70    65    99  10.50000 -1.0 2.0
   81    99    91   100   1.10000 -1.0 2.0
  105   101   100    91   1.10000 -1.0 2.0
  105   109   107   108   1.10000 -1.0 2.0
  113   115   108   107   1.10000 -1.0 2.0
  108   117   113   114  10.50000 -1.0 2.0
  118   113   117   105   1.00000 -1.0 2.0
  108   116   115   119  15.00000 -1.0 2.0
  120   121   119   115  15.00000 -1.0 2.0
  103    96   102   104  10.50000 -1.0 2.0
   38    46    43    44  10.50000 -1.0 2.0
   64    86    61    57   4.00000 -1.0 2.0
   66    67    64    61   4.00000 -1.0 2.0
   72    73    66    64   4.00000 -1.0 2.0
   88    86    72    66   4.00000 -1.0 2.0
   87    61    86    72   1.00000 -1.0 2.0
   72    90    88    89  10.50000 -1.0 2.0
END
