* LIGAND DATABASE FILE (OPLS2005)
*
001     122   123    220    335     649
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02061    77.20519    58.88726
    3     1 S   H    _H1_     3     1.02120    37.85062  -155.23543
    4     1 S   H    _H2_     4     1.02078   100.42017   -48.20468
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08610   110.54789    58.78698
   26    24 S   HC   HB22    34     1.08641   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   _C28    36     1.82423    98.09624  -178.17126
   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   CM   _C25    37     1.50932   110.82942   160.01157
   38    33 S   OH   _O36   121     1.42807   110.41449    41.05843
   39    38 S   HO   _H30   122     0.96884   106.40668  -179.05353
   40    37 S   C    _C26    38     1.34739   112.69667   129.62806
   41    40 S   O    _O39    39     1.25829   134.79355   178.67087
   42    37 S   CMA  _C24    57     1.47525   123.87811   -53.91166
   43    42 S   OM   _O35    58     1.22189   120.59561   -56.15888
   44    40 S   N    _N4_    40     1.40351   108.82887     0.29871
   45    42 S   CM   _C23    59     1.48869   114.35987   123.91371
   46    45 S   HC   _H29    60     1.08854   115.97104    -0.04846
   47    33 S   CT   _C27    41     1.56993   116.34513   -83.20820
   48    47 S   HC   _H9_    42     1.09797   109.95558   115.60354
   49    44 S   CT   _C32    53     1.45418   128.12681   172.25666
   50    49 S   HC   _H36    54     1.09345   110.12224   180.00000
   51    49 S   HC   _H37    55     1.09393   110.24408    60.00215
   52    49 S   HC   _H38    56     1.09335   110.23689   -59.96879
   53    45 S   CM   _C22    61     1.34121   126.96315   179.96044
   54    53 S   HC   _H28    62     1.08991   116.02542    -0.00000
   55    47 S   CT   _C29    43     1.53066   116.82217    -9.13114
   56    55 S   HC   _H31    44     1.09331   108.11447    40.10096
   57    55 S   HC   _H32    45     1.09342   108.67280   156.42841
   58    53 S   CM   _C21    63     1.44701   128.92017   179.96574
   59    58 S   HC   _H27    64     1.08392   118.53174     0.04846
   60    55 S   CT   _C30    46     1.52033   112.50067   -80.58120
   61    60 S   HC   _H33    47     1.09537   111.68639   -55.25553
   62    60 S   HC   _H34    48     1.09660   109.54386    61.67945
   63    58 S   CM   _C20    65     1.34242   122.57208   179.97202
   64    63 S   HC   _H26    66     1.08873   120.03435     0.04423
   65    60 S   C    _C31    49     1.50829   111.94632   179.96044
   66    65 S   O    _O37    50     1.22469   123.77723     5.35559
   67    63 S   CM   _C19    67     1.44723   123.05524   179.98022
   68    67 S   HC   _H25    68     1.08774   117.02120     0.01978
   69    65 S   OH   _O38    51     1.35523   112.91747  -175.98209
   70    69 S   HO   _H35    52     0.98114   115.52685  -178.72774
   71    67 S   CM   _C18    69     1.34166   122.97655  -180.00000
   72    71 S   HC   _H24    70     1.08756   119.92874     0.00000
   73    71 S   CM   _C17    71     1.44848   123.01047   179.96044
   74    73 S   HC   _H23    72     1.08688   116.23320    -0.05595
   75    73 S   CM   _C16    73     1.34367   122.88263   179.98022
   76    75 S   HC   _H22    74     1.08673   117.14056    -0.12511
   77    75 S   CM   _C14    75     1.46128   126.32258  -179.89165
   78    77 S   CM   _C13    76     1.35060   123.65649  -179.94405
   79    78 S   HC   _H18    77     1.09093   117.08727     0.40007
   80    77 S   CT   _C15   117     1.51026   117.66112     0.31341
   81    80 S   HC   _H19   118     1.09583   112.36179    90.07841
   82    80 S   HC   _H20   119     1.09585   110.67787  -150.54252
   83    80 S   HC   _H21   120     1.09509   110.79828   -29.53542
   84    78 S   CT   _C11    78     1.51367   129.34800   179.98022
   85    84 S   HC   _H8_    79     1.09282   111.03250    -0.01978
   86    84 S   CT   _C12    80     1.53613   107.88514   115.92509
   87    86 S   HC   _H15    81     1.09637   110.65422    60.88515
   88    86 S   HC   _H16    82     1.09580   112.25464   -59.11796
   89    86 S   HC   _H17    83     1.09465   110.79230   179.95154
   90    84 S   CT   _C10    84     1.55386   113.90758  -120.92177
   91    90 S   HC   _H7_    85     1.09982   107.12859    60.01559
   92    90 S   CT   _C33    86     1.54942   117.63904   179.17220
   93    92 S   HC   _H39    87     1.10059   105.78787    63.58749
   94    90 S   OS   _O34    96     1.42923   111.10357   -55.07422
   95    92 S   CT   _C34    88     1.52898   112.52897  -179.73980
   96    95 S   HC   _H40    89     1.09525   110.49046    64.14834
   97    95 S   HC   _H41    90     1.09513   110.88634  -176.52870
   98    95 S   HC   _H42    91     1.09475   111.78759   -55.53800
   99    92 S   CT   _C35    92     1.53067   115.12421   -52.21468
  100    99 S   HC   _H43    93     1.09451   111.71829   -63.93110
  101    99 S   HC   _H44    94     1.09315   112.20778   173.83382
  102    99 S   HC   _H45    95     1.09668   110.01371    55.12141
  103    94 S   CO   _C9_    97     1.42483   111.23853   115.92862
  104   103 S   HC   _H6_    98     1.09633   107.77556    59.93760
  105   103 S   CT   _C8_    99     1.53040   107.82974   179.78511
  106   105 S   HC   _H13   100     1.09767   109.30476    55.81414
  107   105 S   HC   _H14   101     1.09594   109.25932   -60.98240
  108   105 S   CT   _C7_   102     1.52603   110.97257   176.40272
  109   108 S   HC   _H5_   103     1.09466   110.91041  -174.29862
  110   108 S   CT   _C6_   104     1.53095   109.80937   -51.86768
  111   110 S   HC   _H4_   105     1.09935   107.91177   -67.71456
  112   108 S   OH   _O40   115     1.42789   109.12242    67.99470
  113   112 S   HO   _H46   116     0.96896   106.42818    60.05791
  114   110 S   CT   _C5_   106     1.53582   110.88940    52.24477
  115   114 S   HC   _H3_   107     1.09838   110.74957    64.26362
  116   110 S   OH   _O41   113     1.42193   108.93736   175.17598
  117   116 S   HO   _H47   114     0.97076   106.76319    59.97498
  118   103 S   OS   _O33   108     1.42750   110.30343   -59.70104
  119   114 S   CT   _C4_   109     1.52457   112.30115  -175.34848
  120   119 S   HC   _H10   110     1.08988   109.93945    57.83511
  121   119 S   HC   _H11   111     1.08923   109.94119   -62.11600
  122   119 S   HC   _H12   112     1.08940   109.92821   177.85579
  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  14   7   1  12   4   8   3  10   6   3  12   5
   4   2   1   1   6   3   8   5   4   6   3   6   4   3   6   3
   3   2   6   3   1   1   6   3   6   3   9   3  10  15   5   4
   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    47    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    44    47    48    55    42    38    39  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    41    44    47    48    55    56    57    60    49    42    43    45    38    39  
   35    36  
   36  
    0  
   40    41    44    47    48    55    49    42    43    45    46    53    38    39  
   39    40    42    44    47    48    55  
   47  
   41    44    47    48    55    49    50    51    52    42    43    45  
   44    47    49    42  
   43    45    46    53    54    58    44    47  
   45    46    53  
   47    48    55    56    57    60    49    50    51    52  
   46    53    54    58    59    63  
   53    54    58  
   48    55    56    57    60    61    62    65    49    50    51    52  
   55    56    57    60    49  
   50    51    52    55  
   51    52  
   52  
    0  
   54    58    59    63    64    67  
   58    59    63  
   56    57    60    61    62    65    66    69  
   57    60    61    62    65  
   60    61    62    65  
   59    63    64    67    68    71  
   63    64    67  
   61    62    65    66    69    70  
   62    65    66    69  
   65    66    69  
   64    67    68    71    72    73  
   67    68    71  
   66    69    70  
   69    70  
   68    71    72    73    74    75  
   71    72    73  
   70  
    0  
   72    73    74    75    76    77  
   73    74    75  
   74    75    76    77    78    80  
   75    76    77  
   76    77    78    79    84    80    81    82    83  
   77    78    80  
   78    79    84    85    86    90    80    81    82    83  
   79    84    85    86    87    88    89    90    91    92    94    80    81    82    83  
   84    85    86    90    80  
   81    82    83    84  
   82    83  
   83  
    0  
   85    86    87    88    89    90    91    92    93    95    99    94   103  
   86    87    88    89    90    91    92    94  
   87    88    89    90    91    92    94  
   88    89    90  
   89    90  
   90  
   91    92    93    95    96    97    98    99   100   101   102    94   103   104   105   118  
   92    93    95    99    94   103  
   93    95    96    97    98    99   100   101   102    94   103  
   95    96    97    98    99   100   101   102    94  
  103   104   105   106   107   108   114   118    95    99  
   96    97    98    99   100   101   102  
   97    98    99  
   98    99  
   99  
  100   101   102  
  101   102  
  102  
    0  
  104   105   106   107   108   109   110   114   115   118   119   112  
  105   106   107   108   114   118  
  106   107   108   109   110   111   114   118   116   112   113  
  107   108   109   110   118   112  
  108   109   110   118   112  
  109   110   111   114   115   118   119   116   117   112   113  
  110   111   114   116   112   113  
  111   114   115   118   119   120   121   122   116   117   112   113  
  114   115   118   119   116   117   112  
  113   114   116  
    0  
  115   118   119   120   121   122   116   117  
  118   119   120   121   122   116  
  117   118   119  
    0  
  119   120   121   122  
  120   121   122  
  121   122  
  122  
    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   0.432500   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   0.0760  -0.657900   2.0020   1.7750   0.023028004  -0.852763146
   38   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   39   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   40   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   42   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   44   3.2500   0.1700  -0.140000   1.8100   1.6000   0.054801302  -1.445846770
   45   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   46   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660   0.010000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   49   3.5000   0.0660  -0.110000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   53   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   54   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   64   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   65   3.7500   0.1050   0.520000   2.1120   1.8750   0.001000000  -0.126889456
   66   2.9600   0.2100  -0.440000   1.9750   1.7500   0.001000000  -0.126889456
   67   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   68   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   69   3.0000   0.1700  -0.530000   1.7660   1.5600   0.021068034  -0.322181743
   70   0.5000   0.0300   0.450000   0.9960   0.8600   0.030040813  -0.651083722
   71   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   72   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   73   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   74   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   76   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   77   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   78   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   79   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   80   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   92   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   95   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
  104   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
  105   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
  111   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  112   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  113   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  114   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
  115   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  116   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  117   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  118   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
  119   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  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
  122   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    47   268.000  1.529
   33    38   320.000  1.410
   37    40   410.000  1.444
   37    42   465.000  1.376
   40    41   570.000  1.229
   40    44   490.000  1.335
   44    47   337.000  1.449
   44    49   337.000  1.449
   47    48   340.000  1.090
   47    55   268.000  1.529
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    60   268.000  1.529
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    65   317.000  1.522
   65    66   570.000  1.229
   65    69   450.000  1.364
   69    70   553.000  0.945
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   340.000  1.090
   42    43   745.000  1.250
   42    45   465.000  1.376
   45    46   340.000  1.080
   45    53   549.000  1.340
   53    54   340.000  1.080
   53    58   380.000  1.444
   58    59   340.000  1.080
   58    63   549.000  1.340
   63    64   340.000  1.080
   63    67   380.000  1.444
   67    68   340.000  1.080
   67    71   549.000  1.340
   71    72   340.000  1.080
   71    73   380.000  1.444
   73    74   340.000  1.080
   73    75   549.000  1.340
   75    76   340.000  1.080
   75    77   380.000  1.444
   77    78   549.000  1.340
   77    80   317.000  1.510
   78    79   340.000  1.080
   78    84   317.000  1.510
   84    85   340.000  1.090
   84    86   268.000  1.529
   84    90   268.000  1.529
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    89   340.000  1.090
   90    91   340.000  1.090
   90    92   268.000  1.529
   90    94   320.000  1.410
   92    93   340.000  1.090
   92    95   268.000  1.529
   92    99   268.000  1.529
   95    96   340.000  1.090
   95    97   340.000  1.090
   95    98   340.000  1.090
   99   100   340.000  1.090
   99   101   340.000  1.090
   99   102   340.000  1.090
   94   103   320.000  1.380
  103   104   340.000  1.090
  103   105   250.000  1.527
  103   118   320.000  1.380
  105   106   340.000  1.090
  105   107   340.000  1.090
  105   108   268.000  1.529
  108   109   340.000  1.090
  108   110   268.000  1.529
  108   112   320.000  1.410
  110   111   340.000  1.090
  110   114   268.000  1.529
  110   116   320.000  1.410
  114   115   340.000  1.090
  114   118   320.000  1.410
  114   119   268.000  1.529
  119   120   340.000  1.090
  119   121   340.000  1.090
  119   122   340.000  1.090
  116   117   553.000  0.945
  112   113   553.000  0.945
   80    81   340.000  1.090
   80    82   340.000  1.090
   80    83   340.000  1.090
   38    39   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    75.00000  112.20000
   29    33    47    75.00000  111.63000
   29    33    38    85.00000  114.68000
   33    37    40    70.00000  119.70000
   33    37    42    70.00000  124.00000
   33    47    44    70.00000  110.72300
   33    47    48    37.50000  110.70000
   33    47    55    58.35000  112.70000
   33    38    39    55.00000  108.50000
   37    40    41    80.00000  125.30000
   37    40    44    80.00000  111.56200
   37    42    43    65.00000  137.10300
   37    42    45    70.00000  123.01800
   40    44    47    50.00000  121.90000
   40    44    49    50.00000  121.90000
   44    40    41    80.00000  122.90000
   44    47    48    35.00000  109.50000
   44    47    55    70.00000  110.72300
   44    49    50    35.00000  109.50000
   44    49    51    35.00000  109.50000
   44    49    52    35.00000  109.50000
   47    33    37    70.00000  112.02700
   47    55    56    37.50000  110.70000
   47    55    57    37.50000  110.70000
   47    55    60    58.35000  112.70000
   55    47    48    37.50000  110.70000
   55    60    61    37.50000  110.70000
   55    60    62    37.50000  110.70000
   55    60    65    63.00000  111.10000
   57    55    56    33.00000  107.80000
   60    55    56    37.50000  110.70000
   60    55    57    37.50000  110.70000
   60    65    66    80.00000  120.40000
   60    65    69    70.00000  108.00000
   62    60    61    33.00000  107.80000
   65    60    61    35.00000  109.50000
   65    60    62    35.00000  109.50000
   65    69    70    35.00000  113.00000
   69    65    66   100.00000  123.32000
   49    44    47    50.00000  118.00000
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    33.00000  107.80000
   42    37    40    60.00000  120.04000
   42    45    46    40.00000  120.50800
   42    45    53    70.00000  117.34000
   45    42    43    65.00000  137.10300
   45    53    54    35.00000  120.00000
   45    53    58    70.00000  123.01800
   53    45    46    35.00000  120.00000
   53    58    59    35.00000  120.00000
   53    58    63    70.00000  123.01800
   58    53    54    35.00000  120.00000
   58    63    64    35.00000  120.00000
   58    63    67    70.00000  123.01800
   63    58    59    35.00000  120.00000
   63    67    68    35.00000  120.00000
   63    67    71    70.00000  123.01800
   67    63    64    35.00000  120.00000
   67    71    72    35.00000  120.00000
   67    71    73    70.00000  123.01800
   71    67    68    35.00000  120.00000
   71    73    74    35.00000  120.00000
   71    73    75    70.00000  123.01800
   73    71    72    35.00000  120.00000
   73    75    76    35.00000  120.00000
   73    75    77    70.00000  123.01800
   75    73    74    35.00000  120.00000
   75    77    78    70.00000  123.01800
   75    77    80    70.00000  124.00000
   77    75    76    35.00000  120.00000
   77    78    79    35.00000  120.00000
   77    78    84    70.00000  124.00000
   77    80    81    35.00000  109.50000
   77    80    82    35.00000  109.50000
   77    80    83    35.00000  109.50000
   78    84    85    35.00000  109.50000
   78    84    86    70.00000  112.02700
   78    84    90    70.00000  112.02700
   84    78    79    35.00000  117.00000
   84    86    87    37.50000  110.70000
   84    86    88    37.50000  110.70000
   84    86    89    37.50000  110.70000
   84    90    91    37.50000  110.70000
   84    90    92    58.35000  112.70000
   84    90    94    50.00000  109.50000
   86    84    85    37.50000  110.70000
   88    86    87    33.00000  107.80000
   89    86    87    33.00000  107.80000
   89    86    88    33.00000  107.80000
   90    84    85    37.50000  110.70000
   90    84    86    58.35000  112.70000
   90    92    93    37.50000  110.70000
   90    92    95    58.35000  112.70000
   90    92    99    58.35000  112.70000
   90    94   103    60.00000  109.50000
   92    90    91    37.50000  110.70000
   92    95    96    37.50000  110.70000
   92    95    97    37.50000  110.70000
   92    95    98    37.50000  110.70000
   92    99   100    37.50000  110.70000
   92    99   101    37.50000  110.70000
   92    99   102    37.50000  110.70000
   95    92    93    37.50000  110.70000
   97    95    96    33.00000  107.80000
   98    95    96    33.00000  107.80000
   98    95    97    33.00000  107.80000
   99    92    93    37.50000  110.70000
   99    92    95    58.35000  112.70000
  101    99   100    33.00000  107.80000
  102    99   100    33.00000  107.80000
  102    99   101    33.00000  107.80000
   94    90    91    35.00000  109.50000
   94    90    92    50.00000  109.50000
   94   103   104    35.00000  109.50000
   94   103   105    90.00000  108.56700
   94   103   118    92.60000  111.55000
  103   105   106    45.00000  108.72000
  103   105   107    45.00000  108.72000
  103   105   108    75.00000  109.43000
  103   118   114    60.00000  109.50000
  105   103   104    45.00000  112.01100
  105   108   109    37.50000  110.70000
  105   108   110    58.35000  112.70000
  105   108   112    50.00000  109.50000
  107   105   106    33.00000  107.80000
  108   105   106    37.50000  110.70000
  108   105   107    37.50000  110.70000
  108   110   111    37.50000  110.70000
  108   110   114    58.35000  112.70000
  108   110   116    50.00000  109.50000
  108   112   113    55.00000  108.50000
  110   108   109    37.50000  110.70000
  110   114   115    37.50000  110.70000
  110   114   118    50.00000  109.50000
  110   114   119    58.35000  112.70000
  110   116   117    55.00000  108.50000
  114   110   111    37.50000  110.70000
  114   119   120    37.50000  110.70000
  114   119   121    37.50000  110.70000
  114   119   122    37.50000  110.70000
  118   103   104    35.00000  109.50000
  118   103   105    90.00000  108.56700
  118   114   115    35.00000  109.50000
  119   114   115    37.50000  110.70000
  119   114   118    50.00000  109.50000
  121   119   120    33.00000  107.80000
  122   119   120    33.00000  107.80000
  122   119   121    33.00000  107.80000
  116   110   111    35.00000  109.50000
  116   110   114    50.00000  109.50000
  112   108   109    35.00000  109.50000
  112   108   110    50.00000  109.50000
   80    77    78    70.00000  124.00000
   82    80    81    33.00000  107.80000
   83    80    81    33.00000  107.80000
   83    80    82    33.00000  107.80000
   38    33    37    90.00000  110.39200
   38    33    47    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  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    47   0.01700  1.0 1.0
   24    29    33    47  -0.23550 -1.0 2.0
   24    29    33    47   0.21350  1.0 3.0
   24    29    33    38   0.13850  1.0 1.0
   24    29    33    38  -1.34450 -1.0 2.0
   24    29    33    38   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    40   0.09700  1.0 1.0
   29    33    37    40   0.15600 -1.0 2.0
   29    33    37    40  -0.50800  1.0 3.0
   29    33    37    42   0.42700  1.0 1.0
   29    33    37    42  -0.70350 -1.0 2.0
   29    33    37    42  -0.43150  1.0 3.0
   29    33    47    44   0.56750  1.0 1.0
   29    33    47    44  -0.07550 -1.0 2.0
   29    33    47    44   0.20000  1.0 3.0
   29    33    47    48   0.15000  1.0 3.0
   29    33    47    55   0.44750  1.0 1.0
   29    33    47    55  -0.17800 -1.0 2.0
   29    33    47    55   0.20200  1.0 3.0
   29    33    38    39   0.35600  1.0 1.0
   29    33    38    39  -0.10750 -1.0 2.0
   29    33    38    39  -0.54400  1.0 3.0
   33    37    40    41  -0.64400  1.0 1.0
   33    37    40    41   0.26850 -1.0 2.0
   33    37   -40    44   1.59650  1.0 1.0
   33    37   -40    44   0.42750 -1.0 2.0
   33    37   -40    44  -0.48350  1.0 3.0
   33    37    42    43   7.00000 -1.0 2.0
   33    37    42    45   7.00000 -1.0 2.0
   33    47    55    56   0.15000  1.0 3.0
   33    47    55    57   0.15000  1.0 3.0
   33    47    55    60   0.56750  1.0 1.0
   33    47    55    60  -0.07550 -1.0 2.0
   33    47    55    60   0.20000  1.0 3.0
   37    33   -47    44   0.21700  1.0 1.0
   37    33   -47    44   0.68550 -1.0 2.0
   37    33   -47    44  -0.27950  1.0 3.0
   37    33    47    48   0.15000  1.0 3.0
   37    33    47    55   0.34400  1.0 1.0
   37    33    47    55   0.09450 -1.0 2.0
   37    33    47    55   0.11100  1.0 3.0
   37    33    38    39  -0.07800  1.0 1.0
   37    33    38    39  -0.21500 -1.0 2.0
   37    33    38    39  -0.03150  1.0 3.0
   37    40   -44    47   1.49850  1.0 1.0
   37    40   -44    47   1.53950 -1.0 2.0
   37    40    44    49   1.49850  1.0 1.0
   37    40    44    49   1.53950 -1.0 2.0
   37    42    45    46   7.00000 -1.0 2.0
   37    42    45    53   7.00000 -1.0 2.0
   40    37    42    43   7.00000 -1.0 2.0
   40    37    42    45   7.00000 -1.0 2.0
   40    44   -47    33  -0.43950  1.0 1.0
   40    44   -47    33  -0.08100 -1.0 2.0
   40    44   -47    33   0.03350  1.0 3.0
   40    44    47    48   0.00000  1.0 1.0
   40    44    47    55  -0.43950  1.0 1.0
   40    44    47    55  -0.08100 -1.0 2.0
   40    44    47    55   0.03350  1.0 3.0
   40    44    49    50   0.00000  1.0 1.0
   40    44    49    51   0.00000  1.0 1.0
   40    44    49    52   0.00000  1.0 1.0
   41    40    44    47   3.04450 -1.0 2.0
   41    40    44    49   3.04450 -1.0 2.0
   44    47    55    56   0.15000  1.0 3.0
   44    47    55    57   0.15000  1.0 3.0
   44    47    55    60   0.43900  1.0 1.0
   44    47    55    60   0.49100 -1.0 2.0
   44    47    55    60   0.28400  1.0 3.0
   47    33   -37    40   0.09700  1.0 1.0
   47    33   -37    40   0.15600 -1.0 2.0
   47    33   -37    40  -0.50800  1.0 3.0
   47    33    37    42   0.09850  1.0 1.0
   47    33    37    42   0.15250 -1.0 2.0
   47    33    37    42  -0.50650  1.0 3.0
   47    33    38    39  -0.11600  1.0 1.0
   47    33    38    39  -0.09450 -1.0 2.0
   47    33    38    39   0.21250  1.0 3.0
   47    44    49    50   0.00000  1.0 1.0
   47    44    49    51   0.00000  1.0 1.0
   47    44    49    52   0.00000  1.0 1.0
   47    55    60    61   0.15000  1.0 3.0
   47    55    60    62   0.15000  1.0 3.0
   47    55    60    65  -0.95700  1.0 1.0
   47    55    60    65  -0.18200 -1.0 2.0
   47    55    60    65   0.29450  1.0 3.0
   48    47    55    56   0.15000  1.0 3.0
   48    47    55    57   0.15000  1.0 3.0
   48    47    55    60   0.15000  1.0 3.0
   55    60    65    66   0.30150 -1.0 2.0
   55    60    65    69   0.50000  1.0 1.0
   55    60    65    69   0.27300 -1.0 2.0
   55    60    65    69   0.22500  1.0 3.0
   56    55    60    61   0.15000  1.0 3.0
   56    55    60    62   0.15000  1.0 3.0
   56    55    60    65  -0.11250  1.0 3.0
   57    55    60    61   0.15000  1.0 3.0
   57    55    60    62   0.15000  1.0 3.0
   57    55    60    65  -0.11250  1.0 3.0
   60    65    69    70   1.50000  1.0 1.0
   60    65    69    70   2.45000 -1.0 2.0
   61    60    65    66   0.00000  1.0 1.0
   61    60    65    69   0.00000  1.0 1.0
   62    60    65    66   0.00000  1.0 1.0
   62    60    65    69   0.00000  1.0 1.0
   66    65    69    70   0.92200  1.0 1.0
   66    65    69    70   3.74100 -1.0 2.0
   49    44    47    33   0.00000  1.0 1.0
   49    44    47    48   0.00000  1.0 1.0
   49    44    47    55  -0.05900 -1.0 2.0
   42    37    40    41   1.00000 -1.0 2.0
   42    37    40    44   0.49500  1.0 1.0
   42    37    40    44   1.31600 -1.0 2.0
   42    37    40    44  -0.02300  1.0 3.0
   42    45    53    54   7.00000 -1.0 2.0
   42    45    53    58   7.00000 -1.0 2.0
   43    42    45    46   7.00000 -1.0 2.0
   43    42    45    53   7.00000 -1.0 2.0
   45    53    58    59  -0.18600  1.0 3.0
   45    53    58    63   0.28850  1.0 1.0
   45    53    58    63   2.61350 -1.0 2.0
   45    53    58    63   0.78400  1.0 3.0
   46    45    53    54   7.00000 -1.0 2.0
   46    45    53    58   7.00000 -1.0 2.0
   53    58    63    64   7.00000 -1.0 2.0
   53    58    63    67   7.00000 -1.0 2.0
   54    53    58    59   0.00000  1.0 1.0
   54    53    58    63  -0.18600  1.0 3.0
   58    63    67    68  -0.18600  1.0 3.0
   58    63    67    71   0.28850  1.0 1.0
   58    63    67    71   2.61350 -1.0 2.0
   58    63    67    71   0.78400  1.0 3.0
   59    58    63    64   7.00000 -1.0 2.0
   59    58    63    67   7.00000 -1.0 2.0
   63    67    71    72   7.00000 -1.0 2.0
   63    67    71    73   7.00000 -1.0 2.0
   64    63    67    68   0.00000  1.0 1.0
   64    63    67    71  -0.18600  1.0 3.0
   67    71    73    74  -0.18600  1.0 3.0
   67    71    73    75   0.28850  1.0 1.0
   67    71    73    75   2.61350 -1.0 2.0
   67    71    73    75   0.78400  1.0 3.0
   68    67    71    72   7.00000 -1.0 2.0
   68    67    71    73   7.00000 -1.0 2.0
   71    73    75    76   7.00000 -1.0 2.0
   71    73    75    77   7.00000 -1.0 2.0
   72    71    73    74   0.00000  1.0 1.0
   72    71    73    75  -0.18600  1.0 3.0
   73    75    77    78   0.28850  1.0 1.0
   73    75    77    78   2.61350 -1.0 2.0
   73    75    77    78   0.78400  1.0 3.0
   73    75    77    80  -0.18600  1.0 3.0
   74    73    75    76   7.00000 -1.0 2.0
   74    73    75    77   7.00000 -1.0 2.0
   75    77    78    79   7.00000 -1.0 2.0
   75    77    78    84   7.00000 -1.0 2.0
   75    77    80    81   0.00000  1.0 1.0
   75    77    80    82   0.00000  1.0 1.0
   75    77    80    83   0.00000  1.0 1.0
   76    75    77    78  -0.18600  1.0 3.0
   76    75    77    80   0.00000  1.0 1.0
   77    78    84    85   0.00000  1.0 1.0
   77    78    84    86   0.09850  1.0 1.0
   77    78    84    86   0.15250 -1.0 2.0
   77    78    84    86  -0.50650  1.0 3.0
   77    78    84    90   0.09850  1.0 1.0
   77    78    84    90   0.15250 -1.0 2.0
   77    78    84    90  -0.50650  1.0 3.0
   78    77    80    81   0.00000  1.0 1.0
   78    77    80    82   0.00000  1.0 1.0
   78    77    80    83   0.00000  1.0 1.0
   78    84    86    87   0.15000  1.0 3.0
   78    84    86    88   0.15000  1.0 3.0
   78    84    86    89   0.15000  1.0 3.0
   78    84    90    91   0.15000  1.0 3.0
   78    84    90    92   0.34400  1.0 1.0
   78    84    90    92   0.09450 -1.0 2.0
   78    84    90    92   0.11100  1.0 3.0
   78    84    90    94   0.61850  1.0 1.0
   78    84    90    94  -0.22750 -1.0 2.0
   78    84    90    94   0.15300  1.0 3.0
   79    78    84    85   0.33100  1.0 3.0
   79    78    84    86   0.00000  1.0 1.0
   79    78    84    90   0.00000  1.0 1.0
   84    90    92    93   0.15000  1.0 3.0
   84    90    92    95   0.56750  1.0 1.0
   84    90    92    95  -0.07550 -1.0 2.0
   84    90    92    95   0.20000  1.0 3.0
   84    90    92    99   0.56750  1.0 1.0
   84    90    92    99  -0.07550 -1.0 2.0
   84    90    92    99   0.20000  1.0 3.0
   84    90    94   103   0.06250  1.0 1.0
   84    90    94   103  -0.01100 -1.0 2.0
   84    90    94   103   0.28050  1.0 3.0
   85    84    86    87   0.15000  1.0 3.0
   85    84    86    88   0.15000  1.0 3.0
   85    84    86    89   0.15000  1.0 3.0
   85    84    90    91   0.15000  1.0 3.0
   85    84    90    92   0.15000  1.0 3.0
   85    84    90    94   0.23400  1.0 3.0
   86    84    90    91   0.15000  1.0 3.0
   86    84    90    92   0.56750  1.0 1.0
   86    84    90    92  -0.07550 -1.0 2.0
   86    84    90    92   0.20000  1.0 3.0
   86    84    90    94   0.62750  1.0 1.0
   86    84    90    94  -0.30950 -1.0 2.0
   86    84    90    94   0.27300  1.0 3.0
   90    84    86    87   0.15000  1.0 3.0
   90    84    86    88   0.15000  1.0 3.0
   90    84    86    89   0.15000  1.0 3.0
   90    92    95    96   0.15000  1.0 3.0
   90    92    95    97   0.15000  1.0 3.0
   90    92    95    98   0.15000  1.0 3.0
   90    92    99   100   0.15000  1.0 3.0
   90    92    99   101   0.15000  1.0 3.0
   90    92    99   102   0.15000  1.0 3.0
   90    94   103   104   0.37050  1.0 3.0
   90    94   103   105   0.06250  1.0 1.0
   90    94   103   105  -0.01100 -1.0 2.0
   90    94   103   105   0.28050  1.0 3.0
   90    94   103   118  -0.53350  1.0 1.0
   90    94   103   118  -0.78350 -1.0 2.0
   90    94   103   118   0.33750  1.0 3.0
   91    90    92    93   0.15000  1.0 3.0
   91    90    92    95   0.15000  1.0 3.0
   91    90    92    99   0.15000  1.0 3.0
   91    90    94   103   0.37050  1.0 3.0
   92    90    94   103   0.06250  1.0 1.0
   92    90    94   103  -0.01100 -1.0 2.0
   92    90    94   103   0.28050  1.0 3.0
   93    92    95    96   0.15000  1.0 3.0
   93    92    95    97   0.15000  1.0 3.0
   93    92    95    98   0.15000  1.0 3.0
   93    92    99   100   0.15000  1.0 3.0
   93    92    99   101   0.15000  1.0 3.0
   93    92    99   102   0.15000  1.0 3.0
   95    92    99   100   0.15000  1.0 3.0
   95    92    99   101   0.15000  1.0 3.0
   95    92    99   102   0.15000  1.0 3.0
   99    92    95    96   0.15000  1.0 3.0
   99    92    95    97   0.15000  1.0 3.0
   99    92    95    98   0.15000  1.0 3.0
   94    90    92    93   0.23400  1.0 3.0
   94    90    92    95   0.62750  1.0 1.0
   94    90    92    95  -0.30950 -1.0 2.0
   94    90    92    95   0.27300  1.0 3.0
   94    90    92    99   0.62750  1.0 1.0
   94    90    92    99  -0.30950 -1.0 2.0
   94    90    92    99   0.27300  1.0 3.0
   94   103   105   106   0.23400  1.0 3.0
   94   103   105   107   0.23400  1.0 3.0
   94   103   105   108   0.62750  1.0 1.0
   94   103   105   108  -0.30950 -1.0 2.0
   94   103   105   108   0.27300  1.0 3.0
   94   103   118   114  -0.81800  1.0 1.0
  103   105   108   109   0.15000  1.0 3.0
  103   105   108   110   3.97050  1.0 1.0
  103   105   108   112   0.86500  1.0 1.0
  103   105   108   112  -0.17500 -1.0 2.0
  103   105   108   112   0.20800  1.0 3.0
  104   103   105   106   0.15000  1.0 3.0
  104   103   105   107   0.15000  1.0 3.0
  104   103   105   108   0.15000  1.0 3.0
  104   103   118   114   0.37050  1.0 3.0
  105   103   118   114   0.06250  1.0 1.0
  105   103   118   114  -0.01100 -1.0 2.0
  105   103   118   114   0.28050  1.0 3.0
  105   108   110   111   0.15000  1.0 3.0
  105   108  -110   114   0.56750  1.0 1.0
  105   108  -110   114  -0.07550 -1.0 2.0
  105   108  -110   114   0.20000  1.0 3.0
  105   108   110   116   0.86500  1.0 1.0
  105   108   110   116  -0.17500 -1.0 2.0
  105   108   110   116   0.20800  1.0 3.0
  105   108   112   113  -0.11600  1.0 1.0
  105   108   112   113  -0.09450 -1.0 2.0
  105   108   112   113   0.21250  1.0 3.0
  106   105   108   109   0.15000  1.0 3.0
  106   105   108   110   0.15000  1.0 3.0
  106   105   108   112   0.23400  1.0 3.0
  107   105   108   109   0.15000  1.0 3.0
  107   105   108   110   0.15000  1.0 3.0
  107   105   108   112   0.23400  1.0 3.0
  108   110   114   115   0.15000  1.0 3.0
  108   110   114   118   0.62750  1.0 1.0
  108   110   114   118  -0.30950 -1.0 2.0
  108   110   114   118   0.27300  1.0 3.0
  108   110   114   119   0.56750  1.0 1.0
  108   110   114   119  -0.07550 -1.0 2.0
  108   110   114   119   0.20000  1.0 3.0
  108   110   116   117  -0.11600  1.0 1.0
  108   110   116   117  -0.09450 -1.0 2.0
  108   110   116   117   0.21250  1.0 3.0
  109   108   110   111   0.15000  1.0 3.0
  109   108   110   114   0.15000  1.0 3.0
  109   108   110   116   0.23400  1.0 3.0
  109   108   112   113   0.19450  1.0 3.0
  110   108   112   113  -0.11600  1.0 1.0
  110   108   112   113  -0.09450 -1.0 2.0
  110   108   112   113   0.21250  1.0 3.0
  110   114  -118   103   0.06250  1.0 1.0
  110   114  -118   103  -0.01100 -1.0 2.0
  110   114  -118   103   0.28050  1.0 3.0
  110   114   119   120   0.15000  1.0 3.0
  110   114   119   121   0.15000  1.0 3.0
  110   114   119   122   0.15000  1.0 3.0
  111   110   114   115   0.15000  1.0 3.0
  111   110   114   118   0.23400  1.0 3.0
  111   110   114   119   0.15000  1.0 3.0
  111   110   116   117   0.19450  1.0 3.0
  114   110   116   117  -0.11600  1.0 1.0
  114   110   116   117  -0.09450 -1.0 2.0
  114   110   116   117   0.21250  1.0 3.0
  115   114   118   103   0.37050  1.0 3.0
  115   114   119   120   0.15000  1.0 3.0
  115   114   119   121   0.15000  1.0 3.0
  115   114   119   122   0.15000  1.0 3.0
  118   103   105   106   0.23400  1.0 3.0
  118   103   105   107   0.23400  1.0 3.0
  118   103  -105   108   0.62750  1.0 1.0
  118   103  -105   108  -0.30950 -1.0 2.0
  118   103  -105   108   0.27300  1.0 3.0
  118   114   119   120   0.23400  1.0 3.0
  118   114   119   121   0.23400  1.0 3.0
  118   114   119   122   0.23400  1.0 3.0
  119   114   118   103   0.06250  1.0 1.0
  119   114   118   103  -0.01100 -1.0 2.0
  119   114   118   103   0.28050  1.0 3.0
  116   110   114   115   0.23400  1.0 3.0
  116   110   114   118   3.69350  1.0 1.0
  116   110   114   118  -1.82950 -1.0 2.0
  116   110   114   119   0.86500  1.0 1.0
  116   110   114   119  -0.17500 -1.0 2.0
  116   110   114   119   0.20800  1.0 3.0
  112   108   110   111   0.23400  1.0 3.0
  112   108   110   114   0.86500  1.0 1.0
  112   108   110   114  -0.17500 -1.0 2.0
  112   108   110   114   0.20800  1.0 3.0
  112   108   110   116   3.75450  1.0 1.0
   80    77    78    79   7.00000 -1.0 2.0
   80    77    78    84   7.00000 -1.0 2.0
   38    33    37    40   0.09700  1.0 1.0
   38    33    37    40   0.15600 -1.0 2.0
   38    33    37    40  -0.50800  1.0 3.0
   38    33    37    42   0.67800  1.0 1.0
   38    33    37    42   0.47050 -1.0 2.0
   38    33    37    42  -0.62500  1.0 3.0
   38    33    47    44   2.76900  1.0 1.0
   38    33    47    44  -0.24350 -1.0 2.0
   38    33    47    44  -0.78250  1.0 3.0
   38    33    47    48   0.23400  1.0 3.0
   38    33    47    55   0.86500  1.0 1.0
   38    33    47    55  -0.17500 -1.0 2.0
   38    33    47    55   0.20800  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    40    37    42   1.10000 -1.0 2.0
   37    44    40    41  10.50000 -1.0 2.0
   49    40    44    47   1.00000 -1.0 2.0
   60    69    65    66  10.50000 -1.0 2.0
   45    43    42    37   1.10000 -1.0 2.0
   42    46    45    53  15.00000 -1.0 2.0
   58    54    53    45  15.00000 -1.0 2.0
   53    59    58    63  15.00000 -1.0 2.0
   67    64    63    58  15.00000 -1.0 2.0
   63    68    67    71  15.00000 -1.0 2.0
   73    72    71    67  15.00000 -1.0 2.0
   71    74    73    75  15.00000 -1.0 2.0
   77    76    75    73  15.00000 -1.0 2.0
   75    80    77    78  15.00000 -1.0 2.0
   84    79    78    77  15.00000 -1.0 2.0
END
