* LIGAND DATABASE FILE (OPLS2005)
*
001     121   122    221    334     649
    1     0 S   NP   _N1_     1    28.78321    91.64461   -20.94577
    2     1 S   H    _HN1     2     1.02940    97.69190    44.37818
    3     1 S   H    _H1_     3     1.02804    19.25113   164.90978
    4     1 S   H    _H2_     4     1.03062    95.39933   -64.40910
    5     1 S   CT   _CA1     5     1.50086   130.15045   169.38259
    6     5 S   HC   _HA1     6     1.09572   105.30099    55.53256
    7     5 S   CO3  _C1_     7     1.53824   112.10537   -64.61256
    8     7 S   O2Z  _O11     8     1.26379   114.97913   -45.62779
    9     7 S   O2Z  _O12     9     1.26236   114.96731   133.53721
   10     5 S   CT   _CB1    10     1.53155   107.61165   173.37478
   11    10 S   HC   HB11    11     1.09808   109.16501   -53.03614
   12    10 S   HC   HB12    12     1.09813   110.41503    63.52664
   13    10 S   CT   _CG1    13     1.53016   112.87205  -174.24439
   14    13 S   HC   HG11    14     1.09602   110.22977   -63.30335
   15    13 S   HC   HG12    15     1.09644   110.11174    55.80694
   16    13 S   C    _CD1    16     1.51923   112.42649   175.99572
   17    16 S   O    _OE1    17     1.22737   123.28335   -10.28451
   18    16 S   N    _N2_    18     1.38653   111.60738   170.49140
   19    18 S   H    _HN2    19     1.01598   118.93909     0.08847
   20    18 S   CT1  _CA2    20     1.46284   123.54063   179.65226
   21    20 S   HC   _HA2    21     1.09571   109.09466   -16.78511
   22    20 S   C    _C2_    22     1.53445   107.71579  -132.00948
   23    22 S   O    _O2_    23     1.22989   122.64303  -144.78031
   24    20 S   CT   _CB2    32     1.53491   111.82679   106.05813
   25    24 S   HC   HB21    33     1.09661   109.42906    59.36188
   26    24 S   HC   HB22    34     1.09506   111.18659   176.62038
   27    22 S   N    _N3_    24     1.38464   113.26121    42.05638
   28    27 S   H    _HN3    25     1.01648   119.42690    -2.37100
   29    24 S   S    _SG2    35     1.83022   114.09659   -59.78421
   30    27 S   CT   _CA3    26     1.45297   123.12679   177.29513
   31    30 S   HC   HA31    27     1.09543   107.35196   -70.10393
   32    30 S   HC   HA32    28     1.09563   108.18183    46.35929
   33    29 S   CT   _C22    36     1.84199   100.28768   -76.13243
   34    33 S   HC   _H9_    37     1.09142   106.45174    40.62239
   35    30 S   CO3  _C3_    29     1.52944   114.14581   168.63831
   36    35 S   O2Z  _O31    30     1.26359   116.07688     3.81619
   37    35 S   O2Z  _O32    31     1.26442   114.42258  -176.07534
   38    33 S   CM   _C21    38     1.50683   107.87183   158.50719
   39    38 S   HC   _H29    39     1.08877   117.59520    57.98507
   40    33 S   CM   _C23    96     1.50732   109.37984   -80.35241
   41    40 S   HC   _H30    97     1.09275   115.06564   -40.85066
   42    38 S   CM   _C20    40     1.34250   122.76359  -121.63456
   43    42 S   HC   _H28    41     1.08782   119.33163    -0.63489
   44    40 S   CMA  _C24    98     1.35493   128.56319   137.87958
   45    44 S   OM   _O39    99     1.26501   127.56047  -176.57823
   46    42 S   CM   _C19    42     1.44511   123.54504   177.83481
   47    46 S   HC   _H27    43     1.08741   117.23684    -1.55041
   48    44 S   CT   _C25   100     1.52893   119.89257     3.97404
   49    48 S   HC   _H10   101     1.09478   113.46698    13.55886
   50    46 S   CM   _C18    44     1.34144   122.49235  -179.48149
   51    50 S   HC   _H26    45     1.08814   119.80328    -1.50207
   52    48 S   CO4  _C26   102     1.51724   112.15152  -107.63356
   53    52 S   O    _O35   103     1.22550   124.55770    55.64104
   54    50 S   CM   _C17    46     1.44649   123.23749   175.70582
   55    54 S   HC   _H25    47     1.08719   117.08758     1.29271
   56    52 S   CT1  _C27   104     1.51476   111.39700  -125.44632
   57    56 S   HC   _H11   105     1.09538   108.48529   113.77663
   58    54 S   CM   _C16    48     1.34268   122.51042  -175.87014
   59    58 S   HC   _H24    49     1.08907   119.54791    -3.34293
   60    56 S   N    _N4_   106     1.46067   101.16244     0.59149
   61    56 S   CTJ  _C30   113     1.52949   112.67036  -122.40532
   62    61 S   HC   _H34   114     1.09720   108.85220  -178.23121
   63    61 S   HC   _H35   115     1.09768   108.85384   -62.77754
   64    58 S   CM   _C14    50     1.45932   125.66058   174.81662
   65    48 S   C    _C28   107     1.52368   115.22841   133.94854
   66    65 S   O    _O36   108     1.22311   125.35831   -57.53379
   67    60 S   CT   _C29   109     1.45018   120.60687   176.13700
   68    67 S   HC   _H31   110     1.09336   108.81254   -55.22000
   69    67 S   HC   _H32   111     1.09312   110.71197  -175.28042
   70    67 S   HC   _H33   112     1.09277   109.27314    64.63719
   71    61 S   CTI  _C31   116     1.53030   114.58970    59.31870
   72    71 S   HC   _H36   117     1.09658   109.87559   -61.73649
   73    71 S   HC   _H37   118     1.09637   110.02792    56.29964
   74    64 S   CM   _C13    51     1.34837   120.97384   -42.99864
   75    74 S   HC   _H20    52     1.09083   118.15972     3.96512
   76    64 S   CT   _C15    92     1.50306   113.82883   141.32052
   77    76 S   HC   _H21    93     1.09528   110.45139    71.48295
   78    76 S   HC   _H22    94     1.09633   110.46665   -48.25497
   79    76 S   HC   _H23    95     1.09265   113.11524  -167.15207
   80    71 S   CO3  _C32   119     1.53299   114.92941   177.13235
   81    80 S   O2Z  _O38   120     1.26531   114.02573  -178.82897
   82    80 S   O2Z  _O37   121     1.26133   116.71135     0.95573
   83    74 S   CT   _C11    53     1.51724   128.29336  -172.24432
   84    83 S   HC   _H8_    54     1.09386   109.48369     5.25829
   85    83 S   CT   _C12    55     1.53046   107.96034  -112.77983
   86    85 S   HC   _H17    56     1.09583   111.44298   -68.45828
   87    85 S   HC   _H18    57     1.09418   111.38045   170.73227
   88    85 S   HC   _H19    58     1.09631   111.06715    51.82210
   89    83 S   CT   _C10    59     1.56035   109.62810   123.64370
   90    89 S   HC   _H7_    60     1.09970   108.59341    52.90878
   91    89 S   CT   _C33    61     1.55462   114.17018   173.19433
   92    91 S   HC   _H38    62     1.09631   108.71252   -59.61734
   93    89 S   OS   _O34    71     1.44048   107.88995   -66.71136
   94    91 S   CT   _C34    63     1.53247   113.13393    60.58497
   95    94 S   HC   _H39    64     1.09499   111.64559    59.50229
   96    94 S   HC   _H40    65     1.09375   111.50853   -61.61474
   97    94 S   HC   _H41    66     1.09564   110.54925   179.35502
   98    91 S   CT   _C35    67     1.53399   111.16006  -176.55849
   99    98 S   HC   _H42    68     1.09488   111.80740   -66.30876
  100    98 S   HC   _H43    69     1.09552   110.55475   173.81176
  101    98 S   HC   _H44    70     1.09497   110.81481    54.65502
  102    93 S   CO   _C9_    72     1.43377   114.17474   121.53716
  103   102 S   HC   _H6_    73     1.09707   109.35133    48.58720
  104   102 S   CT   _C8_    74     1.53241   106.91435   167.71122
  105   104 S   HC   _H15    75     1.09763   109.28003    55.74621
  106   104 S   HC   _H16    76     1.09655   109.22896   -60.89556
  107   104 S   CT   _C7_    77     1.52582   111.14919   176.35793
  108   107 S   HC   _H5_    78     1.09545   111.01426  -174.35774
  109   107 S   CT   _C6_    79     1.53275   109.92646   -52.20831
  110   109 S   HC   _H4_    80     1.09769   108.33384   -67.37024
  111   107 S   OH   _O40    90     1.42839   109.25945    67.85410
  112   111 S   HO   _H45    91     0.97286   107.51894    61.36432
  113   109 S   CT   _C5_    81     1.53358   110.59554    52.18496
  114   113 S   HC   _H3_    82     1.09750   110.95581    65.28050
  115   109 S   OH   _O41    88     1.42513   110.57446   174.70025
  116   115 S   HO   _H46    89     0.97319   107.18146    54.92728
  117   102 S   OS   _O33    83     1.42763   111.23117   -72.46033
  118   113 S   CT   _C4_    84     1.52472   111.58342  -174.48982
  119   118 S   HC   _H12    85     1.09522   110.86454    59.35357
  120   118 S   HC   _H13    86     1.09156   111.76869   -61.76957
  121   118 S   HC   _H14    87     1.09538   110.35487   177.46048
  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   8   5   4   3
  11   6   2   1   1   9   4   8   3   6   3   9   4   6   3  10
   6   6   3  11   5   6   3  15   7   9   3  10  10   5   4  10
   5   1   3   2   1   1   5   4   3  15   5   4   2   1   1   2
   1   1  13   8   7   3   2   1  16   6  11   9  10   7   3   2
   1   3   2   1   1  12   6  11   6   5  11   6  12   7   3   1
   8   6   3   1   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    42    40    41    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    43    46    40    41    44    45    48  
   38    39    42    40    41    44  
   36    37  
   37  
    0  
   39    42    43    46    47    50    40    41    44  
   42    43    46    40  
   41    44    45    48    49    52    65    42  
   44    45    48  
   43    46    47    50    51    54  
   46    47    50  
   45    48    49    52    53    56    60    65    66  
   48    49    52    65  
   47    50    51    54    55    58  
   50    51    54  
   49    52    53    56    57    60    65    66    67    61  
   52    53    56    60    65    66  
   51    54    55    58    59    64  
   54    55    58  
   53    56    57    60    65    66    67    61    62    63    71  
   56    57    60    65    61  
   55    58    59    64    74    76  
   58    59    64  
   57    60    65    66    67    68    69    70    61    62    63    71    72    73    80  
   60    65    67    61    62    63    71  
   59    64    74    75    83    76    77    78    79  
   64    74    76  
   65    66    67    68    69    70    61    62    63    71  
   62    63    71    72    73    80    81    82    65    67  
   63    71    72    73    80  
   71    72    73    80  
   74    75    83    84    85    89    76    77    78    79  
   66    67    68    69    70  
   67  
   68    69    70  
   69    70  
   70  
    0  
   72    73    80    81    82  
   73    80    81    82  
   80    81    82  
   75    83    84    85    86    87    88    89    90    91    93    76    77    78    79  
   83    84    85    89    76  
   77    78    79    83  
   78    79  
   79  
    0  
   81    82  
   82  
    0  
   84    85    86    87    88    89    90    91    92    94    98    93   102  
   85    86    87    88    89    90    91    93  
   86    87    88    89    90    91    93  
   87    88    89  
   88    89  
   89  
   90    91    92    94    95    96    97    98    99   100   101    93   102   103   104   117  
   91    92    94    98    93   102  
   92    94    95    96    97    98    99   100   101    93   102  
   94    95    96    97    98    99   100   101    93  
  102   103   104   105   106   107   113   117    94    98  
   95    96    97    98    99   100   101  
   96    97    98  
   97    98  
   98  
   99   100   101  
  100   101  
  101  
    0  
  103   104   105   106   107   108   109   113   114   117   118   111  
  104   105   106   107   113   117  
  105   106   107   108   109   110   113   117   115   111   112  
  106   107   108   109   117   111  
  107   108   109   117   111  
  108   109   110   113   114   117   118   115   116   111   112  
  109   110   113   115   111   112  
  110   113   114   117   118   119   120   121   115   116   111   112  
  113   114   117   118   115   116   111  
  112   113   115  
    0  
  114   117   118   119   120   121   115   116  
  117   118   119   120   121   115  
  116   117   118  
    0  
  118   119   120   121  
  119   120   121  
  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   0.107500   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   41   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   43   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   45   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   46   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   47   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   51   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   52   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   53   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   54   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   55   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660   0.010000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   58   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   59   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   60   3.2500   0.1700  -0.140000   1.8100   1.6000   0.054801302  -1.445846770
   61   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   65   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   66   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   67   3.5000   0.0660  -0.110000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   71   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   74   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   75   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   76   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   81   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   82   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   83   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   91   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   94   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
  103   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
  104   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  105   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
  108   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  112   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  113   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
  114   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  115   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  116   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  117   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
  118   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  119   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  120   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  121   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    40   317.000  1.510
   38    39   340.000  1.080
   38    42   549.000  1.340
   42    43   340.000  1.080
   42    46   380.000  1.444
   46    47   340.000  1.080
   46    50   549.000  1.340
   50    51   340.000  1.080
   50    54   380.000  1.444
   54    55   340.000  1.080
   54    58   549.000  1.340
   58    59   340.000  1.080
   58    64   380.000  1.444
   64    74   549.000  1.340
   64    76   317.000  1.510
   74    75   340.000  1.080
   74    83   317.000  1.510
   83    84   340.000  1.090
   83    85   268.000  1.529
   83    89   268.000  1.529
   85    86   340.000  1.090
   85    87   340.000  1.090
   85    88   340.000  1.090
   89    90   340.000  1.090
   89    91   268.000  1.529
   89    93   320.000  1.410
   91    92   340.000  1.090
   91    94   268.000  1.529
   91    98   268.000  1.529
   94    95   340.000  1.090
   94    96   340.000  1.090
   94    97   340.000  1.090
   98    99   340.000  1.090
   98   100   340.000  1.090
   98   101   340.000  1.090
   93   102   320.000  1.380
  102   103   340.000  1.090
  102   104   250.000  1.527
  102   117   320.000  1.380
  104   105   340.000  1.090
  104   106   340.000  1.090
  104   107   268.000  1.529
  107   108   340.000  1.090
  107   109   268.000  1.529
  107   111   320.000  1.410
  109   110   340.000  1.090
  109   113   268.000  1.529
  109   115   320.000  1.410
  113   114   340.000  1.090
  113   117   320.000  1.410
  113   118   268.000  1.529
  118   119   340.000  1.090
  118   120   340.000  1.090
  118   121   340.000  1.090
  115   116   553.000  0.945
  111   112   553.000  0.945
   76    77   340.000  1.090
   76    78   340.000  1.090
   76    79   340.000  1.090
   40    41   340.000  1.080
   40    44   465.000  1.376
   44    45   745.000  1.250
   44    48   270.000  1.512
   48    49   340.000  1.090
   48    52   317.000  1.522
   48    65   317.000  1.522
   52    53   570.000  1.229
   52    56   255.000  1.522
   56    57   340.000  1.090
   56    60   337.000  1.449
   56    61   268.000  1.529
   60    65   490.000  1.335
   60    67   337.000  1.449
   65    66   570.000  1.229
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    71   268.000  1.529
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    80   317.000  1.522
   80    81   656.000  1.250
   80    82   656.000  1.250
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  112.20000
   29    33    40    75.00000  112.20000
   33    38    39    35.00000  117.00000
   33    38    42    70.00000  124.00000
   33    40    41    35.00000  117.00000
   33    40    44    70.00000  124.00000
   38    33    34    35.00000  109.50000
   38    42    43    35.00000  120.00000
   38    42    46    70.00000  123.01800
   42    38    39    35.00000  120.00000
   42    46    47    35.00000  120.00000
   42    46    50    70.00000  123.01800
   46    42    43    35.00000  120.00000
   46    50    51    35.00000  120.00000
   46    50    54    70.00000  123.01800
   50    46    47    35.00000  120.00000
   50    54    55    35.00000  120.00000
   50    54    58    70.00000  123.01800
   54    50    51    35.00000  120.00000
   54    58    59    35.00000  120.00000
   54    58    64    70.00000  123.01800
   58    54    55    35.00000  120.00000
   58    64    74    70.00000  123.01800
   58    64    76    70.00000  124.00000
   64    58    59    35.00000  120.00000
   64    74    75    35.00000  120.00000
   64    74    83    70.00000  124.00000
   64    76    77    35.00000  109.50000
   64    76    78    35.00000  109.50000
   64    76    79    35.00000  109.50000
   74    83    84    35.00000  109.50000
   74    83    85    70.00000  112.02700
   74    83    89    70.00000  112.02700
   83    74    75    35.00000  117.00000
   83    85    86    37.50000  110.70000
   83    85    87    37.50000  110.70000
   83    85    88    37.50000  110.70000
   83    89    90    37.50000  110.70000
   83    89    91    58.35000  112.70000
   83    89    93    50.00000  109.50000
   85    83    84    37.50000  110.70000
   87    85    86    33.00000  107.80000
   88    85    86    33.00000  107.80000
   88    85    87    33.00000  107.80000
   89    83    84    37.50000  110.70000
   89    83    85    58.35000  112.70000
   89    91    92    37.50000  110.70000
   89    91    94    58.35000  112.70000
   89    91    98    58.35000  112.70000
   89    93   102    60.00000  109.50000
   91    89    90    37.50000  110.70000
   91    94    95    37.50000  110.70000
   91    94    96    37.50000  110.70000
   91    94    97    37.50000  110.70000
   91    98    99    37.50000  110.70000
   91    98   100    37.50000  110.70000
   91    98   101    37.50000  110.70000
   94    91    92    37.50000  110.70000
   96    94    95    33.00000  107.80000
   97    94    95    33.00000  107.80000
   97    94    96    33.00000  107.80000
   98    91    92    37.50000  110.70000
   98    91    94    58.35000  112.70000
  100    98    99    33.00000  107.80000
  101    98    99    33.00000  107.80000
  101    98   100    33.00000  107.80000
   93    89    90    35.00000  109.50000
   93    89    91    50.00000  109.50000
   93   102   103    35.00000  109.50000
   93   102   104    90.00000  108.56700
   93   102   117    92.60000  111.55000
  102   104   105    45.00000  108.72000
  102   104   106    45.00000  108.72000
  102   104   107    75.00000  109.43000
  102   117   113    60.00000  109.50000
  104   102   103    45.00000  112.01100
  104   107   108    37.50000  110.70000
  104   107   109    58.35000  112.70000
  104   107   111    50.00000  109.50000
  106   104   105    33.00000  107.80000
  107   104   105    37.50000  110.70000
  107   104   106    37.50000  110.70000
  107   109   110    37.50000  110.70000
  107   109   113    58.35000  112.70000
  107   109   115    50.00000  109.50000
  107   111   112    55.00000  108.50000
  109   107   108    37.50000  110.70000
  109   113   114    37.50000  110.70000
  109   113   117    50.00000  109.50000
  109   113   118    58.35000  112.70000
  109   115   116    55.00000  108.50000
  113   109   110    37.50000  110.70000
  113   118   119    37.50000  110.70000
  113   118   120    37.50000  110.70000
  113   118   121    37.50000  110.70000
  117   102   103    35.00000  109.50000
  117   102   104    90.00000  108.56700
  117   113   114    35.00000  109.50000
  118   113   114    37.50000  110.70000
  118   113   117    50.00000  109.50000
  120   118   119    33.00000  107.80000
  121   118   119    33.00000  107.80000
  121   118   120    33.00000  107.80000
  115   109   110    35.00000  109.50000
  115   109   113    50.00000  109.50000
  111   107   108    35.00000  109.50000
  111   107   109    50.00000  109.50000
   76    64    74    70.00000  124.00000
   78    76    77    33.00000  107.80000
   79    76    77    33.00000  107.80000
   79    76    78    33.00000  107.80000
   40    33    34    35.00000  109.50000
   40    33    38    70.00000  110.12100
   40    44    45    65.00000  137.10300
   40    44    48    65.00000  122.18000
   44    40    41    40.00000  120.50800
   44    48    49    45.00000  110.52000
   44    48    52    70.00000  109.06800
   44    48    65    70.00000  115.00700
   48    44    45    85.00000  112.85300
   48    52    53    80.00000  120.40000
   48    52    56    65.00000  117.09000
   48    65    60    70.00000  116.60000
   48    65    66    80.00000  120.40000
   52    48    49    35.00000  109.50000
   52    56    57    45.00000  110.09800
   52    56    60    80.00000  110.29000
   52    56    61    65.00000  117.82000
   56    52    53    75.00000  123.42600
   56    60    65    50.00000  121.90000
   56    60    67    70.00000  118.74000
   56    61    62    37.50000  110.70000
   56    61    63    37.50000  110.70000
   56    61    71    58.35000  112.70000
   60    56    57    35.00000  109.50000
   60    65    66    80.00000  122.90000
   60    67    68    35.00000  109.50000
   60    67    69    35.00000  109.50000
   60    67    70    35.00000  109.50000
   65    48    49    35.00000  109.50000
   65    48    52    70.00000  107.85200
   67    60    65    50.00000  121.90000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   61    56    57    37.50000  110.70000
   61    56    60    80.00000  109.70000
   61    71    72    37.50000  110.70000
   61    71    73    37.50000  110.70000
   61    71    80    63.00000  111.10000
   63    61    62    33.00000  107.80000
   71    61    62    37.50000  110.70000
   71    61    63    37.50000  110.70000
   71    80    81    70.00000  117.00000
   71    80    82    70.00000  117.00000
   73    71    72    33.00000  107.80000
   80    71    72    35.00000  109.50000
   80    71    73    35.00000  109.50000
   82    80    81    80.00000  126.00000
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  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    40  -0.62250  1.0 1.0
   24    29    33    40  -0.38450 -1.0 2.0
   24    29    33    40   0.81900  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   0.00000  1.0 1.0
   29    33    38    42   0.42700  1.0 1.0
   29    33    38    42  -0.70350 -1.0 2.0
   29    33    38    42  -0.43150  1.0 3.0
   29    33    40    41   0.00000  1.0 1.0
   29    33    40    44   0.42700  1.0 1.0
   29    33    40    44  -0.70350 -1.0 2.0
   29    33    40    44  -0.43150  1.0 3.0
   33    38    42    43   7.00000 -1.0 2.0
   33    38    42    46   7.00000 -1.0 2.0
   33    40    44    45   7.00000 -1.0 2.0
   33    40    44    48   7.00000 -1.0 2.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    40    41   0.33100  1.0 3.0
   34    33    40    44   0.00000  1.0 1.0
   38    33    40    41   0.00000  1.0 1.0
   38    33    40    44  -0.28300  1.0 1.0
   38    33    40    44   0.26700 -1.0 2.0
   38    33    40    44  -0.63300  1.0 3.0
   38    42    46    47  -0.18600  1.0 3.0
   38    42    46    50   0.28850  1.0 1.0
   38    42    46    50   2.61350 -1.0 2.0
   38    42    46    50   0.78400  1.0 3.0
   39    38    42    43   7.00000 -1.0 2.0
   39    38    42    46   7.00000 -1.0 2.0
   42    46    50    51   7.00000 -1.0 2.0
   42    46    50    54   7.00000 -1.0 2.0
   43    42    46    47   0.00000  1.0 1.0
   43    42    46    50  -0.18600  1.0 3.0
   46    50    54    55  -0.18600  1.0 3.0
   46    50    54    58   0.28850  1.0 1.0
   46    50    54    58   2.61350 -1.0 2.0
   46    50    54    58   0.78400  1.0 3.0
   47    46    50    51   7.00000 -1.0 2.0
   47    46    50    54   7.00000 -1.0 2.0
   50    54    58    59   7.00000 -1.0 2.0
   50    54    58    64   7.00000 -1.0 2.0
   51    50    54    55   0.00000  1.0 1.0
   51    50    54    58  -0.18600  1.0 3.0
   54    58    64    74   0.28850  1.0 1.0
   54    58    64    74   2.61350 -1.0 2.0
   54    58    64    74   0.78400  1.0 3.0
   54    58    64    76  -0.18600  1.0 3.0
   55    54    58    59   7.00000 -1.0 2.0
   55    54    58    64   7.00000 -1.0 2.0
   58    64    74    75   7.00000 -1.0 2.0
   58    64    74    83   7.00000 -1.0 2.0
   58    64    76    77   0.00000  1.0 1.0
   58    64    76    78   0.00000  1.0 1.0
   58    64    76    79   0.00000  1.0 1.0
   59    58    64    74  -0.18600  1.0 3.0
   59    58    64    76   0.00000  1.0 1.0
   64    74    83    84   0.00000  1.0 1.0
   64    74    83    85   0.09850  1.0 1.0
   64    74    83    85   0.15250 -1.0 2.0
   64    74    83    85  -0.50650  1.0 3.0
   64    74    83    89   0.09850  1.0 1.0
   64    74    83    89   0.15250 -1.0 2.0
   64    74    83    89  -0.50650  1.0 3.0
   74    64    76    77   0.00000  1.0 1.0
   74    64    76    78   0.00000  1.0 1.0
   74    64    76    79   0.00000  1.0 1.0
   74    83    85    86   0.15000  1.0 3.0
   74    83    85    87   0.15000  1.0 3.0
   74    83    85    88   0.15000  1.0 3.0
   74    83    89    90   0.15000  1.0 3.0
   74    83    89    91   0.34400  1.0 1.0
   74    83    89    91   0.09450 -1.0 2.0
   74    83    89    91   0.11100  1.0 3.0
   74    83    89    93   0.61850  1.0 1.0
   74    83    89    93  -0.22750 -1.0 2.0
   74    83    89    93   0.15300  1.0 3.0
   75    74    83    84   0.33100  1.0 3.0
   75    74    83    85   0.00000  1.0 1.0
   75    74    83    89   0.00000  1.0 1.0
   83    89    91    92   0.15000  1.0 3.0
   83    89    91    94   0.56750  1.0 1.0
   83    89    91    94  -0.07550 -1.0 2.0
   83    89    91    94   0.20000  1.0 3.0
   83    89    91    98   0.56750  1.0 1.0
   83    89    91    98  -0.07550 -1.0 2.0
   83    89    91    98   0.20000  1.0 3.0
   83    89    93   102   0.06250  1.0 1.0
   83    89    93   102  -0.01100 -1.0 2.0
   83    89    93   102   0.28050  1.0 3.0
   84    83    85    86   0.15000  1.0 3.0
   84    83    85    87   0.15000  1.0 3.0
   84    83    85    88   0.15000  1.0 3.0
   84    83    89    90   0.15000  1.0 3.0
   84    83    89    91   0.15000  1.0 3.0
   84    83    89    93   0.23400  1.0 3.0
   85    83    89    90   0.15000  1.0 3.0
   85    83    89    91   0.56750  1.0 1.0
   85    83    89    91  -0.07550 -1.0 2.0
   85    83    89    91   0.20000  1.0 3.0
   85    83    89    93   0.62750  1.0 1.0
   85    83    89    93  -0.30950 -1.0 2.0
   85    83    89    93   0.27300  1.0 3.0
   89    83    85    86   0.15000  1.0 3.0
   89    83    85    87   0.15000  1.0 3.0
   89    83    85    88   0.15000  1.0 3.0
   89    91    94    95   0.15000  1.0 3.0
   89    91    94    96   0.15000  1.0 3.0
   89    91    94    97   0.15000  1.0 3.0
   89    91    98    99   0.15000  1.0 3.0
   89    91    98   100   0.15000  1.0 3.0
   89    91    98   101   0.15000  1.0 3.0
   89    93   102   103   0.37050  1.0 3.0
   89    93   102   104   0.06250  1.0 1.0
   89    93   102   104  -0.01100 -1.0 2.0
   89    93   102   104   0.28050  1.0 3.0
   89    93   102   117  -0.53350  1.0 1.0
   89    93   102   117  -0.78350 -1.0 2.0
   89    93   102   117   0.33750  1.0 3.0
   90    89    91    92   0.15000  1.0 3.0
   90    89    91    94   0.15000  1.0 3.0
   90    89    91    98   0.15000  1.0 3.0
   90    89    93   102   0.37050  1.0 3.0
   91    89    93   102   0.06250  1.0 1.0
   91    89    93   102  -0.01100 -1.0 2.0
   91    89    93   102   0.28050  1.0 3.0
   92    91    94    95   0.15000  1.0 3.0
   92    91    94    96   0.15000  1.0 3.0
   92    91    94    97   0.15000  1.0 3.0
   92    91    98    99   0.15000  1.0 3.0
   92    91    98   100   0.15000  1.0 3.0
   92    91    98   101   0.15000  1.0 3.0
   94    91    98    99   0.15000  1.0 3.0
   94    91    98   100   0.15000  1.0 3.0
   94    91    98   101   0.15000  1.0 3.0
   98    91    94    95   0.15000  1.0 3.0
   98    91    94    96   0.15000  1.0 3.0
   98    91    94    97   0.15000  1.0 3.0
   93    89    91    92   0.23400  1.0 3.0
   93    89    91    94   0.62750  1.0 1.0
   93    89    91    94  -0.30950 -1.0 2.0
   93    89    91    94   0.27300  1.0 3.0
   93    89    91    98   0.62750  1.0 1.0
   93    89    91    98  -0.30950 -1.0 2.0
   93    89    91    98   0.27300  1.0 3.0
   93   102   104   105   0.23400  1.0 3.0
   93   102   104   106   0.23400  1.0 3.0
   93   102   104   107   0.62750  1.0 1.0
   93   102   104   107  -0.30950 -1.0 2.0
   93   102   104   107   0.27300  1.0 3.0
   93   102   117   113  -0.81800  1.0 1.0
  102   104   107   108   0.15000  1.0 3.0
  102   104   107   109   3.97050  1.0 1.0
  102   104   107   111   0.86500  1.0 1.0
  102   104   107   111  -0.17500 -1.0 2.0
  102   104   107   111   0.20800  1.0 3.0
  103   102   104   105   0.15000  1.0 3.0
  103   102   104   106   0.15000  1.0 3.0
  103   102   104   107   0.15000  1.0 3.0
  103   102   117   113   0.37050  1.0 3.0
  104   102   117   113   0.06250  1.0 1.0
  104   102   117   113  -0.01100 -1.0 2.0
  104   102   117   113   0.28050  1.0 3.0
  104   107   109   110   0.15000  1.0 3.0
  104   107  -109   113   0.56750  1.0 1.0
  104   107  -109   113  -0.07550 -1.0 2.0
  104   107  -109   113   0.20000  1.0 3.0
  104   107   109   115   0.86500  1.0 1.0
  104   107   109   115  -0.17500 -1.0 2.0
  104   107   109   115   0.20800  1.0 3.0
  104   107   111   112  -0.11600  1.0 1.0
  104   107   111   112  -0.09450 -1.0 2.0
  104   107   111   112   0.21250  1.0 3.0
  105   104   107   108   0.15000  1.0 3.0
  105   104   107   109   0.15000  1.0 3.0
  105   104   107   111   0.23400  1.0 3.0
  106   104   107   108   0.15000  1.0 3.0
  106   104   107   109   0.15000  1.0 3.0
  106   104   107   111   0.23400  1.0 3.0
  107   109   113   114   0.15000  1.0 3.0
  107   109   113   117   0.62750  1.0 1.0
  107   109   113   117  -0.30950 -1.0 2.0
  107   109   113   117   0.27300  1.0 3.0
  107   109   113   118   0.56750  1.0 1.0
  107   109   113   118  -0.07550 -1.0 2.0
  107   109   113   118   0.20000  1.0 3.0
  107   109   115   116  -0.11600  1.0 1.0
  107   109   115   116  -0.09450 -1.0 2.0
  107   109   115   116   0.21250  1.0 3.0
  108   107   109   110   0.15000  1.0 3.0
  108   107   109   113   0.15000  1.0 3.0
  108   107   109   115   0.23400  1.0 3.0
  108   107   111   112   0.19450  1.0 3.0
  109   107   111   112  -0.11600  1.0 1.0
  109   107   111   112  -0.09450 -1.0 2.0
  109   107   111   112   0.21250  1.0 3.0
  109   113  -117   102   0.06250  1.0 1.0
  109   113  -117   102  -0.01100 -1.0 2.0
  109   113  -117   102   0.28050  1.0 3.0
  109   113   118   119   0.15000  1.0 3.0
  109   113   118   120   0.15000  1.0 3.0
  109   113   118   121   0.15000  1.0 3.0
  110   109   113   114   0.15000  1.0 3.0
  110   109   113   117   0.23400  1.0 3.0
  110   109   113   118   0.15000  1.0 3.0
  110   109   115   116   0.19450  1.0 3.0
  113   109   115   116  -0.11600  1.0 1.0
  113   109   115   116  -0.09450 -1.0 2.0
  113   109   115   116   0.21250  1.0 3.0
  114   113   117   102   0.37050  1.0 3.0
  114   113   118   119   0.15000  1.0 3.0
  114   113   118   120   0.15000  1.0 3.0
  114   113   118   121   0.15000  1.0 3.0
  117   102   104   105   0.23400  1.0 3.0
  117   102   104   106   0.23400  1.0 3.0
  117   102  -104   107   0.62750  1.0 1.0
  117   102  -104   107  -0.30950 -1.0 2.0
  117   102  -104   107   0.27300  1.0 3.0
  117   113   118   119   0.23400  1.0 3.0
  117   113   118   120   0.23400  1.0 3.0
  117   113   118   121   0.23400  1.0 3.0
  118   113   117   102   0.06250  1.0 1.0
  118   113   117   102  -0.01100 -1.0 2.0
  118   113   117   102   0.28050  1.0 3.0
  115   109   113   114   0.23400  1.0 3.0
  115   109   113   117   3.69350  1.0 1.0
  115   109   113   117  -1.82950 -1.0 2.0
  115   109   113   118   0.86500  1.0 1.0
  115   109   113   118  -0.17500 -1.0 2.0
  115   109   113   118   0.20800  1.0 3.0
  111   107   109   110   0.23400  1.0 3.0
  111   107   109   113   0.86500  1.0 1.0
  111   107   109   113  -0.17500 -1.0 2.0
  111   107   109   113   0.20800  1.0 3.0
  111   107   109   115   3.75450  1.0 1.0
   76    64    74    75   7.00000 -1.0 2.0
   76    64    74    83   7.00000 -1.0 2.0
   40    33    38    39   0.00000  1.0 1.0
   40    33    38    42  -0.28300  1.0 1.0
   40    33    38    42   0.26700 -1.0 2.0
   40    33    38    42  -0.63300  1.0 3.0
   40    44    48    49   0.00000  1.0 1.0
   40    44    48    52  -0.51250  1.0 1.0
   40    44    48    52  -0.88800 -1.0 2.0
   40    44    48    52   0.08850  1.0 3.0
   40    44    48    65  -0.51250  1.0 1.0
   40    44    48    65  -0.88800 -1.0 2.0
   40    44    48    65   0.08850  1.0 3.0
   41    40    44    45   7.00000 -1.0 2.0
   41    40    44    48   7.00000 -1.0 2.0
   44    48    52    53   0.30150 -1.0 2.0
   44    48    52    56   0.65300  1.0 1.0
   44    48    52    56  -0.03850 -1.0 2.0
   44    48    52    56   0.33900  1.0 3.0
   44    48    65    60   0.00000  1.0 1.0
   44    48    65    66   0.30150 -1.0 2.0
   45    44    48    49   0.00000  1.0 1.0
   45    44    48    52   0.09700  1.0 1.0
   45    44    48    52   0.15600 -1.0 2.0
   45    44    48    52  -0.50800  1.0 3.0
   45    44    48    65   0.09700  1.0 1.0
   45    44    48    65   0.15600 -1.0 2.0
   45    44    48    65  -0.50800  1.0 3.0
   48    52    56    57   0.00000  1.0 1.0
   48    52   -56    60   0.65300  1.0 1.0
   48    52   -56    60  -0.03850 -1.0 2.0
   48    52   -56    60   0.33900  1.0 3.0
   48    52    56    61   0.60050  1.0 1.0
   48    52    56    61   0.05600 -1.0 2.0
   48    52    56    61   0.26150  1.0 3.0
   49    48    52    53   0.00000  1.0 1.0
   49    48    52    56   0.00000  1.0 1.0
   49    48    65    60   0.00000  1.0 1.0
   49    48    65    66   0.00000  1.0 1.0
   52    48   -65    60   0.00000  1.0 1.0
   52    48    65    66   0.30150 -1.0 2.0
   52    56   -60    65  -0.29800  1.0 1.0
   52    56   -60    65   0.13950 -1.0 2.0
   52    56   -60    65  -2.45650  1.0 3.0
   52    56    60    67   0.17850 -1.0 2.0
   52    56    61    62  -0.03800  1.0 3.0
   52    56    61    63  -0.03800  1.0 3.0
   52    56    61    71  -0.76350  1.0 1.0
   52    56    61    71   1.70300 -1.0 2.0
   53    52    56    57   0.00000  1.0 1.0
   53    52    56    60   0.00000  1.0 1.0
   53    52    56    61   0.00000  1.0 1.0
   56    60   -65    48   1.15000  1.0 1.0
   56    60   -65    48   3.04450 -1.0 2.0
   56    60    65    66   3.04450 -1.0 2.0
   56    60    67    68   0.00000  1.0 1.0
   56    60    67    69   0.00000  1.0 1.0
   56    60    67    70   0.00000  1.0 1.0
   56    61    71    72   0.15000  1.0 3.0
   56    61    71    73   0.15000  1.0 3.0
   56    61    71    80  -1.59250  1.0 1.0
   56    61    71    80  -0.41250 -1.0 2.0
   56    61    71    80   0.24650  1.0 3.0
   57    56    60    65   0.00000  1.0 1.0
   57    56    60    67   0.00000  1.0 1.0
   57    56    61    62   0.15000  1.0 3.0
   57    56    61    63   0.15000  1.0 3.0
   57    56    61    71   0.15000  1.0 3.0
   60    56    61    62   0.23200  1.0 3.0
   60    56    61    63   0.23200  1.0 3.0
   60    56    61    71   1.79450  1.0 1.0
   60    56    61    71   1.06000 -1.0 2.0
   60    56    61    71  -0.53000  1.0 3.0
   65    48    52    53   0.30150 -1.0 2.0
   65    48   -52    56   0.65300  1.0 1.0
   65    48   -52    56  -0.03850 -1.0 2.0
   65    48   -52    56   0.33900  1.0 3.0
   65    60    67    68   0.00000  1.0 1.0
   65    60    67    69   0.00000  1.0 1.0
   65    60    67    70   0.00000  1.0 1.0
   67    60    65    48   1.49850  1.0 1.0
   67    60    65    48   1.53950 -1.0 2.0
   67    60    65    66   3.04450 -1.0 2.0
   61    56    60    65   0.25950  1.0 1.0
   61    56    60    65   0.43850 -1.0 2.0
   61    56    60    65   2.61650  1.0 3.0
   61    56    60    67  -0.05900 -1.0 2.0
   61    71    80    81   0.27300 -1.0 2.0
   61    71    80    82   0.27300 -1.0 2.0
   62    61    71    72   0.15000  1.0 3.0
   62    61    71    73   0.15000  1.0 3.0
   62    61    71    80  -0.11250  1.0 3.0
   63    61    71    72   0.15000  1.0 3.0
   63    61    71    73   0.15000  1.0 3.0
   63    61    71    80  -0.11250  1.0 3.0
   72    71    80    81   0.00000  1.0 1.0
   72    71    80    82   0.00000  1.0 1.0
   73    71    80    81   0.00000  1.0 1.0
   73    71    80    82   0.00000  1.0 1.0
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
   33    39    38    42  15.00000 -1.0 2.0
   46    43    42    38  15.00000 -1.0 2.0
   42    47    46    50  15.00000 -1.0 2.0
   54    51    50    46  15.00000 -1.0 2.0
   50    55    54    58  15.00000 -1.0 2.0
   64    59    58    54  15.00000 -1.0 2.0
   58    76    64    74  15.00000 -1.0 2.0
   83    75    74    64  15.00000 -1.0 2.0
   33    41    40    44  15.00000 -1.0 2.0
   48    45    44    40  15.00000 -1.0 2.0
   48    56    52    53  10.50000 -1.0 2.0
   67    65    60    56   1.00000 -1.0 2.0
   48    60    65    66  10.50000 -1.0 2.0
   81    71    80    82  10.50000 -1.0 2.0
END
