* LIGAND DATABASE FILE (OPLS2005)
*
001     122   124    225    335     657
    1     0 S   NP   _N1_     1    29.16747    97.46146   -25.30645
    2     1 S   H    _HN1     2     1.02777   122.19743  -130.27250
    3     1 S   H    _H1_     3     1.02947    77.21232   -26.41730
    4     1 S   H    _H2_     4     1.02831    30.10994   160.96833
    5     1 S   CT   _CA1     5     1.50123   119.20419    79.99648
    6     5 S   HC   _HA1     6     1.09566   105.20834    91.25126
    7     5 S   CO3  _C1_     7     1.53817   112.34719   -29.08402
    8     7 S   O2Z  _O11     8     1.26391   114.98379   -42.75117
    9     7 S   O2Z  _O12     9     1.26209   114.98428   136.28735
   10     5 S   CT   _CB1    10     1.53090   107.44078  -150.61525
   11    10 S   HC   HB11    11     1.09833   109.58645   -47.85351
   12    10 S   HC   HB12    12     1.09810   110.38281    68.81626
   13    10 S   CT   _CG1    13     1.52990   112.53615  -168.70853
   14    13 S   HC   HG11    14     1.09577   110.72581   -63.68607
   15    13 S   HC   HG12    15     1.09674   109.75100    55.50273
   16    13 S   C    _CD1    16     1.51815   112.12635   176.20987
   17    16 S   O    _OE1    17     1.22747   123.37357    10.61604
   18    16 S   N    _N2_    18     1.38524   111.74136  -169.83839
   19    18 S   H    _HN2    19     1.01544   118.99571     0.80624
   20    18 S   CT1  _CA2    20     1.46080   122.81192  -179.87028
   21    20 S   HC   _HA2    21     1.09705   108.46877    34.09678
   22    20 S   C    _C2_    22     1.53231   109.60314   -82.82174
   23    22 S   O    _O2_    23     1.23104   121.13781   156.25256
   24    20 S   CT   _CB2    32     1.53459   111.89736   157.14047
   25    24 S   HC   HB21    33     1.09212   109.17306    60.62067
   26    24 S   HC   HB22    34     1.09336   109.38583   178.32205
   27    22 S   N    _N3_    24     1.38228   114.35257   -31.28055
   28    27 S   H    _HN3    25     1.01594   119.32093     7.25136
   29    24 S   S    _SG2    35     1.82963   111.27449   -61.34438
   30    27 S   CT   _CA3    26     1.45264   123.23220  -177.16793
   31    30 S   HC   HA31    27     1.09532   107.76693   -61.77491
   32    30 S   HC   HA32    28     1.09554   107.80143    54.59447
   33    29 S   CT   _C25    36     1.89923   102.29690   166.55971
   34    30 S   CO3  _C3_    29     1.52911   113.65538   177.15793
   35    34 S   O2Z  _O31    30     1.26385   115.80979    20.73520
   36    34 S   O2Z  _O32    31     1.26377   114.67867  -159.00382
   37    33 S   CT   _C26    37     1.60805   110.53152   -60.45104
   38    37 S   OM   _O35    38     1.32578   109.82065  -161.44816
   39    37 S   HC   _H7_    39     1.09725   101.71053    74.31674
   40    33 S   CT   _C24    80     1.59585   107.19352    61.91002
   41    40 S   HC   _H6_    81     1.09662   108.87533   -66.47612
   42    33 S   CT   _C27   119     1.55494   102.75111   176.76723
   43    42 S   HC   _H25   120     1.09695   111.85799   -62.21969
   44    42 S   HC   _H26   121     1.09450   112.18483   178.55004
   45    42 S   HC   _H27   122     1.09104   113.22167    57.92673
   46    37 S   CT   _C5_    40     1.59771   118.17885   -38.43306
   47    46 S   HC   _H3_    41     1.09486   108.12907    52.65637
   48    40 S   OS   _O36    82     1.45786   107.97283    52.89343
   49    46 S   CT   _C6_    42     1.57043   113.76757   167.59317
   50    49 S   HC   _H4_    43     1.09655   109.39870    70.21018
   51    48 S   CO4  _C28    83     1.36574   118.58776  -132.42109
   52    51 S   O    _O37    84     1.22373   125.98325     0.47188
   53    46 S   CT   _C4_   115     1.54333   115.45934   -64.03851
   54    53 S   HC   _H8_   116     1.09398   112.25578   -55.99144
   55    53 S   HC   _H9_   117     1.09497   111.61228  -176.30774
   56    53 S   HC   _H10   118     1.09074   111.23722    66.44987
   57    49 S   CT   _C7_    44     1.52607   112.66518   -53.81577
   58    57 S   HC   _H11    45     1.09786   109.36795   -53.98675
   59    57 S   HC   _H12    46     1.09370   109.40958    64.98524
   60    51 S   CT   _C29    85     1.51733   109.36424  -179.53860
   61    60 S   HC   _H28    86     1.09714   108.04458    38.61212
   62    57 S   CT   _C8_    47     1.53076   110.13049  -174.31873
   63    60 S   CT   _C30    87     1.52631   110.53776   156.02610
   64    63 S   HC   _H29    88     1.09571   111.49192    63.44861
   65    63 S   HC   _H30    89     1.09563   110.77528   -56.31236
   66    63 S   HC   _H31    90     1.09495   110.79501  -176.19425
   67    60 S   CT   _C31    91     1.52331   109.72699   -81.04309
   68    67 S   HC   _H32    92     1.09574   111.29508   -58.37715
   69    67 S   HC   _H33    93     1.09485   110.96112  -179.00968
   70    67 S   HC   _H34    94     1.09505   110.91495    61.17536
   71    62 S   CT   _C9_    48     1.56150   111.65927   172.50941
   72    71 S   HC   _H5_    49     1.09778   107.84824   -68.43210
   73    62 S   N    _N5_   108     1.45142   109.02602    51.11590
   74    73 S   H    _H44   109     1.01441   117.37026   160.69566
   75    62 S   OH   _O41   113     1.42860   109.50954   -65.08592
   76    75 S   HO   _H45   114     0.97159   108.18174   -52.58344
   77    71 S   CM   _C10    50     1.50879   111.48693    52.97192
   78    77 S   HC   _H13    51     1.08746   116.51241    61.54793
   79    71 S   OS   _O38   103     1.43539   108.72219   173.34725
   80    73 S   CO4  _C35   110     1.37556   125.37654   -27.34827
   81    80 S   O    _O39   111     1.22959   121.95647  -176.36924
   82    77 S   CM   _C11    52     1.34232   123.36871  -113.03773
   83    82 S   HC   _H14    53     1.08604   120.06898    -1.92264
   84    79 S   CT   _C34   104     1.42309   112.80777   153.81234
   85    84 S   HC   _H41   105     1.09331   108.18446   179.55413
   86    84 S   HC   _H42   106     1.09385   111.01031    60.63336
   87    84 S   HC   _H43   107     1.09429   110.40934   -61.90741
   88    49 S   OS   _O40   112     1.45598   107.68825  -174.33960
   89    82 S   CM   _C12    54     1.44292   123.56669   167.68160
   90    89 S   HC   _H15    55     1.08984   112.59655  -125.66113
   91    89 S   CM   _C13    56     1.34697   128.71608    51.60027
   92    91 S   CT   _C14    57     1.51691   119.33319  -172.04135
   93    92 S   HC   _H16    58     1.09804   109.39357   -55.73252
   94    92 S   HC   _H17    59     1.09768   110.78230  -171.14610
   95    91 S   CT   _C33    99     1.50411   125.13498     6.85678
   96    95 S   HC   _H38   100     1.09544   110.01926   129.54964
   97    95 S   HC   _H39   101     1.09337   113.08214    10.58619
   98    95 S   HC   _H40   102     1.09423   110.45569  -110.82764
   99    92 S   CA   _C15    60     1.51556   112.42480    67.34994
  100    99 S   CA   _C16    61     1.40089   120.43320  -108.52353
  101   100 S   HA   _H18    62     1.08824   118.72997    -0.68842
  102   100 S   CA   _C17    63     1.40430   121.32486   177.30703
  103   102 S   CA   _C18    64     1.41214   118.61244     2.16681
  104   103 S   Cl   Cl1_    65     1.74292   121.02300   171.66412
  105   102 S   N    _N4_    74     1.43078   118.39081   177.60804
  106   103 S   CA   _C19    66     1.40973   120.60082    -2.66124
  107   105 S   C    _C22    75     1.39558   124.96069   134.98869
  108   107 S   O    _O34    76     1.23665   122.81513   155.22630
  109   105 S   CT   _C32    95     1.46413   116.04347   -50.73424
  110   109 S   HC   _H35    96     1.09405   109.19549    78.68069
  111   109 S   HC   _H36    97     1.09478   109.93126   -42.24995
  112   109 S   HC   _H37    98     1.09366   111.37359  -162.44564
  113    99 S   CA   _C20    67     1.40146   120.36617    69.37297
  114   113 S   HA   _H19    68     1.08602   118.00891     2.06640
  115   106 S   OS   _O33    69     1.37347   116.63655  -179.47511
  116   107 S   CT   _C23    77     1.53163   118.16844   -30.98645
  117   116 S   HC   _H23    78     1.08831   111.37138    31.41228
  118   116 S   HC   _H24    79     1.09527   105.34040   147.47225
  119   115 S   CT   _C21    70     1.42221   117.61609   175.75421
  120   119 S   HC   _H20    71     1.09429   107.72320  -176.94411
  121   119 S   HC   _H21    72     1.09481   111.04362    65.43621
  122   119 S   HC   _H22    73     1.09508   111.25186   -59.18882
  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  13   5   4   3
  19   2   1   1  20   7   6  16   7   6   2   1   1  13   8  10
  15   7  12   4   5   2   1   1  13   6   5   9   8  14   7   3
   2   1   3   2   1   1  16   7   8   4   4   1   8   4   5   2
   1   6   3   3   2   1   1   1  10   3  10  13   5   4   4   2
   1   1   9  10   4  13   9   4  10   7   8   4   4   2   1   1
   3   1   4   2   1   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    40    42    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    46   116    40    41    48    42    43    44    45  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    46    47    49   107   116   117   118    40    41    48    51    53    42    43    44    45  
   35    36  
   36  
    0  
   38    39    46    47    49    50    57   116    40    41    48    88    53    54    55    56    42    43    44    45  
   39    46    47    49    40    53    42  
   46    47    49    40    53    42  
   41    48    51    52    60    42    43    44    45    46   105   107   108   116   117   118  
   48    51    42   107   116   117   118  
   43    44    45    46    48   116  
   44    45  
   45  
    0  
   47    49    50    57    58    59    62    80    88    53    54    55    56  
   49    50    57    88    53    54    55    56  
   51    52    60    61    63    67   107   116   117   118  
   50    57    58    59    62    71    73    80    81    88    75    53    54    55    56  
   57    58    59    62    80    88    53  
   52    60    61    63    64    65    66    67    68    69    70   116  
   60    61    63    67  
   54    55    56    57    88  
   55    56  
   56  
    0  
   58    59    62    71    72    77    79    73    74    80    88    75    76  
   59    62    71    73    88    75  
   62    71    73    88    75  
   61    63    64    65    66    67    68    69    70  
   63    64    65    66    67    68    69    70  
   71    72    77    78    82    79    84    73    74    80    81    88    75    76  
   64    65    66    67    68    69    70  
   65    66    67  
   66    67  
   67  
   68    69    70  
   69    70  
   70  
    0  
   72    77    78    82    83    89    79    84    85    86    87    73    74    80    75    76  
   77    78    82    79    84    73    75  
   74    80    81    88    75    76    77    79  
   80    81    88    75  
   76    77    79    80  
    0  
   78    82    83    89    90    91    79    84  
   82    83    89    79  
   84    85    86    87    82  
   81    88  
   88  
   83    89    90    91    92    95  
   89    90    91  
   85    86    87  
   86    87  
   87  
    0  
    0  
   90    91    92    93    94    99    95    96    97    98  
   91    92    95  
   92    93    94    99   100   113    95    96    97    98  
   93    94    99   100   101   102   106   113   114    95    96    97    98  
   94    99   100   113    95  
   99   100   113    95  
   96    97    98    99  
   97    98  
   98  
    0  
  100   101   102   103   106   113   114   115   105  
  101   102   103   104   106   113   114   105   107   109  
  102   103   113   105  
  103   104   106   113   115   105   107   108   116   109   110   111   112  
  104   106   113   114   115   119   105   107   109  
  106   113   115   105  
  107   108   116   117   118   109   110   111   112   106  
  113   114   115   119   120   121   122  
  108   116   117   118   109   110   111   112  
  116   117   118   109  
  110   111   112   116  
  111   112  
  112  
    0  
  114   115   119  
  115  
  119   120   121   122  
  117   118  
  118  
    0  
  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   0.167500   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   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   38   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   39   2.5000   0.0500   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   42   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   49   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   51   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   53   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   62   3.5000   0.0660   0.465000   1.9750   1.7500   0.005000000  -0.741685710
   63   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660   0.239000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   73   3.2500   0.1700  -0.438900   1.8100   1.6000   0.054801302  -1.445846770
   74   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   75   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   76   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   77   3.5500   0.0760  -0.184000   2.0020   1.7750   0.023028004  -0.852763146
   78   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   79   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   80   3.7500   0.1050   0.515900   1.9250   1.7000   0.001000000  -0.126889456
   81   2.9600   0.2100  -0.497000   1.5250   1.4250   0.001000000  -1.480495490
   82   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   83   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   84   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   86   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   87   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   88   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   89   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   90   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   91   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   92   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
  100   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  101   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  102   3.5500   0.0700  -0.038300   2.5000   1.7750   0.001000000  -0.843144165
  103   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
  104   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
  105   3.2500   0.1700  -0.031700   1.8100   1.6000   0.054801302  -1.445846770
  106   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
  107   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
  108   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
  109   3.5000   0.0660  -0.110000   1.9750   1.7500   0.005000000  -0.741685710
  110   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
  111   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
  112   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
  113   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  114   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  115   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
  116   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  117   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  118   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  119   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
  120   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  121   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  122   2.5000   0.0300   0.030000   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   268.000  1.529
   33    40   268.000  1.529
   33    42   268.000  1.529
   37    38   570.000  1.307
   37    39   340.000  1.090
   37    46   268.000  1.529
   46    47   340.000  1.090
   46    49   268.000  1.529
   46    53   268.000  1.529
   49    50   340.000  1.090
   49    57   268.000  1.529
   49    88   320.000  1.410
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    62   268.000  1.529
   62    71   268.000  1.529
   62    73   337.000  1.449
   62    75   320.000  1.410
   71    72   340.000  1.090
   71    77   317.000  1.510
   71    79   320.000  1.410
   77    78   340.000  1.080
   77    82   549.000  1.340
   82    83   340.000  1.080
   82    89   380.000  1.444
   89    90   340.000  1.080
   89    91   549.000  1.340
   91    92   317.000  1.510
   91    95   317.000  1.510
   92    93   340.000  1.090
   92    94   340.000  1.090
   92    99   317.000  1.510
   99   100   469.000  1.400
   99   113   469.000  1.400
  100   101   367.000  1.080
  100   102   469.000  1.400
  102   103   469.000  1.400
  102   105   360.000  1.404
  103   104   300.000  1.725
  103   106   469.000  1.400
  106   113   469.000  1.400
  106   115   450.000  1.364
  113   114   367.000  1.080
  115   119   320.000  1.410
  119   120   340.000  1.090
  119   121   340.000  1.090
  119   122   340.000  1.090
  105   107   490.000  1.335
  105   109   337.000  1.449
  107   108   570.000  1.229
  107   116   317.000  1.522
  116   117   340.000  1.090
  116   118   340.000  1.090
  116    40   268.000  1.529
   40    41   340.000  1.090
   40    48   320.000  1.410
   48    51   214.000  1.327
   51    52   570.000  1.229
   51    60   317.000  1.522
   60    61   340.000  1.090
   60    63   268.000  1.529
   60    67   268.000  1.529
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   340.000  1.090
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
  109   110   340.000  1.090
  109   111   340.000  1.090
  109   112   340.000  1.090
   95    96   340.000  1.090
   95    97   340.000  1.090
   95    98   340.000  1.090
   79    84   320.000  1.410
   84    85   340.000  1.090
   84    86   340.000  1.090
   84    87   340.000  1.090
   73    74   434.000  1.010
   73    80   435.000  1.380
   80    81   570.000  1.229
   80    88   214.000  1.327
   75    76   553.000  0.945
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   340.000  1.090
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    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  111.63000
   29    33    40    75.00000  111.63000
   29    33    42    75.00000  111.63000
   33    37    38    50.00000  109.50000
   33    37    39    37.50000  110.70000
   33    37    46    58.35000  112.70000
   33    40   116    58.35000  112.70000
   33    40    41    37.50000  110.70000
   33    40    48    50.00000  109.50000
   33    42    43    37.50000  110.70000
   33    42    44    37.50000  110.70000
   33    42    45    37.50000  110.70000
   37    46    47    37.50000  110.70000
   37    46    49    58.35000  112.70000
   37    46    53    58.35000  112.70000
   39    37    38    45.00000  125.66300
   46    37    38    50.00000  109.50000
   46    37    39    37.50000  110.70000
   46    49    50    37.50000  110.70000
   46    49    57    58.35000  112.70000
   46    49    88    50.00000  109.50000
   46    53    54    37.50000  110.70000
   46    53    55    37.50000  110.70000
   46    53    56    37.50000  110.70000
   49    46    47    37.50000  110.70000
   49    57    58    37.50000  110.70000
   49    57    59    37.50000  110.70000
   49    57    62    58.35000  112.70000
   49    88    80    83.00000  116.90000
   57    49    50    37.50000  110.70000
   57    62    71    58.35000  112.70000
   57    62    73    70.00000  110.72300
   57    62    75    50.00000  109.50000
   59    57    58    33.00000  107.80000
   62    57    58    37.50000  110.70000
   62    57    59    37.50000  110.70000
   62    71    72    37.50000  110.70000
   62    71    77    70.00000  112.02700
   62    71    79    50.00000  109.50000
   62    73    74    38.00000  118.40000
   62    73    80    70.00000  120.44000
   62    75    76    55.00000  108.50000
   71    77    78    35.00000  117.00000
   71    77    82    70.00000  124.00000
   71    79    84    60.00000  109.50000
   77    71    72    35.00000  109.50000
   77    82    83    35.00000  120.00000
   77    82    89    70.00000  123.01800
   82    77    78    35.00000  120.00000
   82    89    90    35.00000  120.00000
   82    89    91    70.00000  123.01800
   89    82    83    35.00000  120.00000
   89    91    92    70.00000  124.00000
   89    91    95    70.00000  124.00000
   91    89    90    35.00000  120.00000
   91    92    93    35.00000  109.50000
   91    92    94    35.00000  109.50000
   91    92    99    70.00000  112.99600
   91    95    96    35.00000  109.50000
   91    95    97    35.00000  109.50000
   91    95    98    35.00000  109.50000
   92    99   100    70.00000  120.00000
   92    99   113    70.00000  120.00000
   94    92    93    33.00000  107.80000
   99    92    93    35.00000  109.50000
   99    92    94    35.00000  109.50000
   99   100   101    35.00000  120.00000
   99   100   102    63.00000  120.00000
   99   113   106    63.00000  120.00000
   99   113   114    35.00000  120.00000
  100   102   103    63.00000  120.00000
  100   102   105    70.00000  119.01900
  102   100   101    35.00000  120.00000
  102   103   104    75.00000  120.00000
  102   103   106    63.00000  120.00000
  102   105   107    65.00000  121.96500
  102   105   109    70.00000  121.06000
  103   106   113    63.00000  120.00000
  103   106   115    70.00000  120.00000
  106   103   104    75.00000  120.00000
  106   113   114    35.00000  120.00000
  106   115   119    75.00000  111.00000
  113    99   100    63.00000  120.00000
  115   106   113    70.00000  120.00000
  115   119   120    35.00000  109.50000
  115   119   121    35.00000  109.50000
  115   119   122    35.00000  109.50000
  121   119   120    33.00000  107.80000
  122   119   120    33.00000  107.80000
  122   119   121    33.00000  107.80000
  105   102   103    70.00000  119.01900
  105   107   108    80.00000  122.90000
  105   107   116    70.00000  116.60000
  105   109   110    35.00000  109.50000
  105   109   111    35.00000  109.50000
  105   109   112    35.00000  109.50000
  107   116   117    35.00000  109.50000
  107   116   118    35.00000  109.50000
  107   116    40    63.00000  111.10000
  116   107   108    80.00000  120.40000
  116    40    41    37.50000  110.70000
  116    40    48    50.00000  109.50000
  118   116   117    33.00000  107.80000
   40    33    37    58.35000  112.70000
   40   116   117    37.50000  110.70000
   40   116   118    37.50000  110.70000
   40    48    51    83.00000  116.90000
   48    40    41    35.00000  109.50000
   48    51    52    83.00000  123.40000
   48    51    60    81.00000  111.40000
   51    60    61    35.00000  109.50000
   51    60    63    63.00000  111.10000
   51    60    67    63.00000  111.10000
   60    51    52    80.00000  120.40000
   60    63    64    37.50000  110.70000
   60    63    65    37.50000  110.70000
   60    63    66    37.50000  110.70000
   60    67    68    37.50000  110.70000
   60    67    69    37.50000  110.70000
   60    67    70    37.50000  110.70000
   63    60    61    37.50000  110.70000
   65    63    64    33.00000  107.80000
   66    63    64    33.00000  107.80000
   66    63    65    33.00000  107.80000
   67    60    61    37.50000  110.70000
   67    60    63    58.35000  112.70000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
  109   105   107    50.00000  121.90000
  111   109   110    33.00000  107.80000
  112   109   110    33.00000  107.80000
  112   109   111    33.00000  107.80000
   95    91    92    65.00000  117.92700
   97    95    96    33.00000  107.80000
   98    95    96    33.00000  107.80000
   98    95    97    33.00000  107.80000
   79    71    72    35.00000  109.50000
   79    71    77    85.00000  110.90400
   79    84    85    35.00000  109.50000
   79    84    86    35.00000  109.50000
   79    84    87    35.00000  109.50000
   86    84    85    33.00000  107.80000
   87    84    85    33.00000  107.80000
   87    84    86    33.00000  107.80000
   73    62    71    70.00000  110.72300
   73    80    81    85.00000  125.96000
   73    80    88   110.00000  108.75700
   80    73    74    50.00000  116.34900
   88    49    50    35.00000  109.50000
   88    49    57    50.00000  109.50000
   88    80    81    83.00000  123.40000
   75    62    71    50.00000  109.50000
   75    62    73    95.00000  111.01700
   53    46    47    37.50000  110.70000
   53    46    49    58.35000  112.70000
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    33.00000  107.80000
   42    33    37    58.35000  112.70000
   42    33    40    58.35000  112.70000
   44    42    43    33.00000  107.80000
   45    42    43    33.00000  107.80000
   45    42    44    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   0.21350  1.0 3.0
   24    29    33    42   0.01700  1.0 1.0
   24    29    33    42  -0.23550 -1.0 2.0
   24    29    33    42   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.56750  1.0 1.0
   29    33    37    38  -0.07550 -1.0 2.0
   29    33    37    38   0.20000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    46   0.44750  1.0 1.0
   29    33    37    46  -0.17800 -1.0 2.0
   29    33    37    46   0.20200  1.0 3.0
   29    33    40   116   0.44750  1.0 1.0
   29    33    40   116  -0.17800 -1.0 2.0
   29    33    40   116   0.20200  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    48   0.56750  1.0 1.0
   29    33    40    48  -0.07550 -1.0 2.0
   29    33    40    48   0.20000  1.0 3.0
   29    33    42    43   0.15000  1.0 3.0
   29    33    42    44   0.15000  1.0 3.0
   29    33    42    45   0.15000  1.0 3.0
   33    37    46    47   0.15000  1.0 3.0
   33    37    46    49   0.56750  1.0 1.0
   33    37    46    49  -0.07550 -1.0 2.0
   33    37    46    49   0.20000  1.0 3.0
   33    37    46    53   0.56750  1.0 1.0
   33    37    46    53  -0.07550 -1.0 2.0
   33    37    46    53   0.20000  1.0 3.0
   33    40    48    51  -0.25900  1.0 1.0
   33    40    48    51  -0.47000 -1.0 2.0
   33    40    48    51   0.11750  1.0 3.0
   37    33    40   116   0.56750  1.0 1.0
   37    33    40   116  -0.07550 -1.0 2.0
   37    33    40   116   0.20000  1.0 3.0
   37    33    40    41   0.15000  1.0 3.0
   37    33    40    48   0.62750  1.0 1.0
   37    33    40    48  -0.30950 -1.0 2.0
   37    33    40    48   0.27300  1.0 3.0
   37    33    42    43   0.15000  1.0 3.0
   37    33    42    44   0.15000  1.0 3.0
   37    33    42    45   0.15000  1.0 3.0
   37    46    49    50   0.15000  1.0 3.0
   37    46    49    57   0.56750  1.0 1.0
   37    46    49    57  -0.07550 -1.0 2.0
   37    46    49    57   0.20000  1.0 3.0
   37    46    49    88   0.62750  1.0 1.0
   37    46    49    88  -0.30950 -1.0 2.0
   37    46    49    88   0.27300  1.0 3.0
   37    46    53    54   0.15000  1.0 3.0
   37    46    53    55   0.15000  1.0 3.0
   37    46    53    56   0.15000  1.0 3.0
   38    37    46    47   0.23400  1.0 3.0
   38    37    46    49   0.62750  1.0 1.0
   38    37    46    49  -0.30950 -1.0 2.0
   38    37    46    49   0.27300  1.0 3.0
   38    37    46    53   0.62750  1.0 1.0
   38    37    46    53  -0.30950 -1.0 2.0
   38    37    46    53   0.27300  1.0 3.0
   39    37    46    47   0.15000  1.0 3.0
   39    37    46    49   0.15000  1.0 3.0
   39    37    46    53   0.15000  1.0 3.0
   46    49    57    58   0.15000  1.0 3.0
   46    49    57    59   0.15000  1.0 3.0
   46    49    57    62   0.56750  1.0 1.0
   46    49    57    62  -0.07550 -1.0 2.0
   46    49    57    62   0.20000  1.0 3.0
   46    49    88    80  -0.25900  1.0 1.0
   46    49    88    80  -0.47000 -1.0 2.0
   46    49    88    80   0.11750  1.0 3.0
   47    46    49    50   0.15000  1.0 3.0
   47    46    49    57   0.15000  1.0 3.0
   47    46    49    88   0.23400  1.0 3.0
   47    46    53    54   0.15000  1.0 3.0
   47    46    53    55   0.15000  1.0 3.0
   47    46    53    56   0.15000  1.0 3.0
   49    46    53    54   0.15000  1.0 3.0
   49    46    53    55   0.15000  1.0 3.0
   49    46    53    56   0.15000  1.0 3.0
   49    57    62    71   0.56750  1.0 1.0
   49    57    62    71  -0.07550 -1.0 2.0
   49    57    62    71   0.20000  1.0 3.0
   49    57    62    73   0.43900  1.0 1.0
   49    57    62    73   0.49100 -1.0 2.0
   49    57    62    73   0.28400  1.0 3.0
   49    57    62    75   0.86500  1.0 1.0
   49    57    62    75  -0.17500 -1.0 2.0
   49    57    62    75   0.20800  1.0 3.0
   50    49    57    58   0.15000  1.0 3.0
   50    49    57    59   0.15000  1.0 3.0
   50    49    57    62   0.15000  1.0 3.0
   50    49    88    80   0.08050  1.0 3.0
   57    49    88    80  -0.25900  1.0 1.0
   57    49    88    80  -0.47000 -1.0 2.0
   57    49    88    80   0.11750  1.0 3.0
   57    62    71    72   0.15000  1.0 3.0
   57    62    71    77   0.34400  1.0 1.0
   57    62    71    77   0.09450 -1.0 2.0
   57    62    71    77   0.11100  1.0 3.0
   57    62    71    79   0.62750  1.0 1.0
   57    62    71    79  -0.30950 -1.0 2.0
   57    62    71    79   0.27300  1.0 3.0
   57    62    73    74   0.00000  1.0 1.0
   57    62   -73    80  -0.43950  1.0 1.0
   57    62   -73    80  -0.08100 -1.0 2.0
   57    62   -73    80   0.03350  1.0 3.0
   57    62    75    76  -0.11600  1.0 1.0
   57    62    75    76  -0.09450 -1.0 2.0
   57    62    75    76   0.21250  1.0 3.0
   58    57    62    71   0.15000  1.0 3.0
   58    57    62    73   0.15000  1.0 3.0
   58    57    62    75   0.23400  1.0 3.0
   59    57    62    71   0.15000  1.0 3.0
   59    57    62    73   0.15000  1.0 3.0
   59    57    62    75   0.23400  1.0 3.0
   62    71    77    78   0.00000  1.0 1.0
   62    71    77    82   0.09850  1.0 1.0
   62    71    77    82   0.15250 -1.0 2.0
   62    71    77    82  -0.50650  1.0 3.0
   62    71    79    84   0.06250  1.0 1.0
   62    71    79    84  -0.01100 -1.0 2.0
   62    71    79    84   0.28050  1.0 3.0
   62    73    80    81   3.04450 -1.0 2.0
   62    73    80    88   2.45000 -1.0 2.0
   71    62    73    74   0.00000  1.0 1.0
   71    62    73    80  -0.43950  1.0 1.0
   71    62    73    80  -0.08100 -1.0 2.0
   71    62    73    80   0.03350  1.0 3.0
   71    62    75    76  -0.11600  1.0 1.0
   71    62    75    76  -0.09450 -1.0 2.0
   71    62    75    76   0.21250  1.0 3.0
   71    77    82    83   7.00000 -1.0 2.0
   71    77    82    89   7.00000 -1.0 2.0
   71    79    84    85   0.37050  1.0 3.0
   71    79    84    86   0.37050  1.0 3.0
   71    79    84    87   0.37050  1.0 3.0
   72    71    77    78   0.33100  1.0 3.0
   72    71    77    82   0.00000  1.0 1.0
   72    71    79    84   0.37050  1.0 3.0
   77    71    79    84  -0.77900  1.0 1.0
   77    71    79    84  -0.36900 -1.0 2.0
   77    71    79    84   0.40400  1.0 3.0
   77    82    89    90  -0.18600  1.0 3.0
   77    82    89    91   0.28850  1.0 1.0
   77    82    89    91   2.61350 -1.0 2.0
   77    82    89    91   0.78400  1.0 3.0
   78    77    82    83   7.00000 -1.0 2.0
   78    77    82    89   7.00000 -1.0 2.0
   82    89    91    92   7.00000 -1.0 2.0
   82    89    91    95   7.00000 -1.0 2.0
   83    82    89    90   0.00000  1.0 1.0
   83    82    89    91  -0.18600  1.0 3.0
   89    91    92    93   0.00000  1.0 1.0
   89    91    92    94   0.00000  1.0 1.0
   89    91    92    99   1.44450  1.0 1.0
   89    91    92    99   0.06600 -1.0 2.0
   89    91    92    99   0.29250  1.0 3.0
   89    91    95    96   0.00000  1.0 1.0
   89    91    95    97   0.00000  1.0 1.0
   89    91    95    98   0.00000  1.0 1.0
   90    89    91    92   7.00000 -1.0 2.0
   90    89    91    95   7.00000 -1.0 2.0
   91    92    99   100   0.18050 -1.0 2.0
   91    92    99   113   0.18050 -1.0 2.0
   92    91    95    96   0.34800  1.0 3.0
   92    91    95    97   0.34800  1.0 3.0
   92    91    95    98   0.34800  1.0 3.0
   92    99   100   101   3.62500 -1.0 2.0
   92    99   100   102   3.62500 -1.0 2.0
   92    99   113   106   3.62500 -1.0 2.0
   92    99   113   114   3.62500 -1.0 2.0
   93    92    99   100   0.00000  1.0 1.0
   93    92    99   113   0.00000  1.0 1.0
   94    92    99   100   0.00000  1.0 1.0
   94    92    99   113   0.00000  1.0 1.0
   99   100   102   103   3.62500 -1.0 2.0
   99   100   102   105   3.62500 -1.0 2.0
  100    99   113   106   3.62500 -1.0 2.0
  100    99   113   114   3.62500 -1.0 2.0
  100   102   103   104   3.62500 -1.0 2.0
  100   102  -103   106   3.62500 -1.0 2.0
  100   102   105   107   1.00100  1.0 1.0
  100   102   105   107   0.85050 -1.0 2.0
  100   102   105   109   0.81400  1.0 1.0
  100   102   105   109   1.55550 -1.0 2.0
  101   100   102   103   3.62500 -1.0 2.0
  101   100   102   105   3.62500 -1.0 2.0
  102   103   106   113   3.62500 -1.0 2.0
  102   103   106   115   3.62500 -1.0 2.0
  102   105   107   108   0.04000 -1.0 2.0
  102   105   107   116   0.76000  1.0 1.0
  102   105   107   116   4.11600 -1.0 2.0
  102   105   109   110   0.00000  1.0 1.0
  102   105   109   111   0.00000  1.0 1.0
  102   105   109   112   0.00000  1.0 1.0
  103   102   105   107   1.00100  1.0 1.0
  103   102   105   107   0.85050 -1.0 2.0
  103   102   105   109   0.81400  1.0 1.0
  103   102   105   109   1.55550 -1.0 2.0
  103   106  -113    99   3.62500 -1.0 2.0
  103   106   113   114   3.62500 -1.0 2.0
  103   106   115   119   1.63200 -1.0 2.0
  104   103   106   113   3.62500 -1.0 2.0
  104   103   106   115   3.62500 -1.0 2.0
  106   115   119   120   0.08050  1.0 3.0
  106   115   119   121   0.08050  1.0 3.0
  106   115   119   122   0.08050  1.0 3.0
  113    99   100   101   3.62500 -1.0 2.0
  113    99  -100   102   3.62500 -1.0 2.0
  113   106   115   119   1.63200 -1.0 2.0
  115   106   113    99   3.62500 -1.0 2.0
  115   106   113   114   3.62500 -1.0 2.0
  105   102   103   104   3.62500 -1.0 2.0
  105   102   103   106   3.62500 -1.0 2.0
  105   107   116   117   0.00000  1.0 1.0
  105   107   116   118   0.00000  1.0 1.0
  105   107   116    40   1.39750  1.0 1.0
  105   107   116    40  -0.07950 -1.0 2.0
  105   107   116    40  -0.18750  1.0 3.0
  107   105   109   110   0.00000  1.0 1.0
  107   105   109   111   0.00000  1.0 1.0
  107   105   109   112   0.00000  1.0 1.0
  107   116    40    33  -0.95700  1.0 1.0
  107   116    40    33  -0.18200 -1.0 2.0
  107   116    40    33   0.29450  1.0 3.0
  107   116    40    41  -0.11250  1.0 3.0
  107   116    40    48  -0.09450  1.0 1.0
  107   116    40    48  -1.12950 -1.0 2.0
  107   116    40    48   0.54000  1.0 3.0
  108   107   116   117   0.00000  1.0 1.0
  108   107   116   118   0.00000  1.0 1.0
  108   107   116    40   0.30150 -1.0 2.0
  116    40    48    51  -0.25900  1.0 1.0
  116    40    48    51  -0.47000 -1.0 2.0
  116    40    48    51   0.11750  1.0 3.0
  117   116    40    33   0.15000  1.0 3.0
  117   116    40    41   0.15000  1.0 3.0
  117   116    40    48   0.23400  1.0 3.0
  118   116    40    33   0.15000  1.0 3.0
  118   116    40    41   0.15000  1.0 3.0
  118   116    40    48   0.23400  1.0 3.0
   40    33    37    38   0.62750  1.0 1.0
   40    33    37    38  -0.30950 -1.0 2.0
   40    33    37    38   0.27300  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    46   0.56750  1.0 1.0
   40    33    37    46  -0.07550 -1.0 2.0
   40    33    37    46   0.20000  1.0 3.0
   40    33    42    43   0.15000  1.0 3.0
   40    33    42    44   0.15000  1.0 3.0
   40    33    42    45   0.15000  1.0 3.0
   40    48    51    52   3.00000 -1.0 2.0
   40    48    51    60   1.63150  1.0 1.0
   40    48    51    60   2.92000 -1.0 2.0
   41    40    48    51   0.08050  1.0 3.0
   48    51    60    61   0.00000  1.0 1.0
   48    51    60    63   0.36750  1.0 3.0
   48    51    60    67   0.36750  1.0 3.0
   51    60    63    64  -0.11250  1.0 3.0
   51    60    63    65  -0.11250  1.0 3.0
   51    60    63    66  -0.11250  1.0 3.0
   51    60    67    68  -0.11250  1.0 3.0
   51    60    67    69  -0.11250  1.0 3.0
   51    60    67    70  -0.11250  1.0 3.0
   52    51    60    61   0.00000  1.0 1.0
   52    51    60    63   0.30150 -1.0 2.0
   52    51    60    67   0.30150 -1.0 2.0
   61    60    63    64   0.15000  1.0 3.0
   61    60    63    65   0.15000  1.0 3.0
   61    60    63    66   0.15000  1.0 3.0
   61    60    67    68   0.15000  1.0 3.0
   61    60    67    69   0.15000  1.0 3.0
   61    60    67    70   0.15000  1.0 3.0
   63    60    67    68   0.15000  1.0 3.0
   63    60    67    69   0.15000  1.0 3.0
   63    60    67    70   0.15000  1.0 3.0
   67    60    63    64   0.15000  1.0 3.0
   67    60    63    65   0.15000  1.0 3.0
   67    60    63    66   0.15000  1.0 3.0
  109   105   107   108   3.04450 -1.0 2.0
  109   105   107   116   1.49850  1.0 1.0
  109   105   107   116   1.53950 -1.0 2.0
   95    91    92    93   0.34800  1.0 3.0
   95    91    92    94   0.34800  1.0 3.0
   95    91    92    99   0.09700  1.0 1.0
   95    91    92    99   0.15600 -1.0 2.0
   95    91    92    99  -0.50800  1.0 3.0
   79    71    77    78   0.00000  1.0 1.0
   79    71    77    82   0.39000  1.0 1.0
   79    71    77    82  -0.05800 -1.0 2.0
   79    71    77    82  -0.55150  1.0 3.0
   73    62    71    72   0.15000  1.0 3.0
   73    62    71    77   0.21700  1.0 1.0
   73    62    71    77   0.68550 -1.0 2.0
   73    62    71    77  -0.27950  1.0 3.0
   73    62    71    79   1.12100  1.0 1.0
   73    62    71    79  -0.16500 -1.0 2.0
   73    62    75    76   0.09550  1.0 1.0
   73    62    75    76   0.17350 -1.0 2.0
   73    62    75    76  -0.55000  1.0 3.0
   73    80   -88    49  -0.80800  1.0 1.0
   73    80   -88    49   2.06850 -1.0 2.0
   74    73    80    81   2.45000 -1.0 2.0
   74    73    80    88   2.56700 -1.0 2.0
   81    80    88    49   3.00000 -1.0 2.0
   88    49    57    58   0.23400  1.0 3.0
   88    49    57    59   0.23400  1.0 3.0
   88    49   -57    62   0.62750  1.0 1.0
   88    49   -57    62  -0.30950 -1.0 2.0
   88    49   -57    62   0.27300  1.0 3.0
   75    62    71    72   0.23400  1.0 3.0
   75    62    71    77   1.05650  1.0 1.0
   75    62    71    77   0.15600 -1.0 2.0
   75    62    71    77   0.53150  1.0 3.0
   75    62    71    79   3.69350  1.0 1.0
   75    62    71    79  -1.82950 -1.0 2.0
   75    62    73    74   0.00000  1.0 1.0
   75    62    73    80  -5.15550  1.0 1.0
   75    62    73    80  -0.87850 -1.0 2.0
   53    46    49    50   0.15000  1.0 3.0
   53    46    49    57   0.56750  1.0 1.0
   53    46    49    57  -0.07550 -1.0 2.0
   53    46    49    57   0.20000  1.0 3.0
   53    46    49    88   0.62750  1.0 1.0
   53    46    49    88  -0.30950 -1.0 2.0
   53    46    49    88   0.27300  1.0 3.0
   42    33    37    38   0.62750  1.0 1.0
   42    33    37    38  -0.30950 -1.0 2.0
   42    33    37    38   0.27300  1.0 3.0
   42    33    37    39   0.15000  1.0 3.0
   42    33    37    46   0.56750  1.0 1.0
   42    33    37    46  -0.07550 -1.0 2.0
   42    33    37    46   0.20000  1.0 3.0
   42    33    40   116   0.56750  1.0 1.0
   42    33    40   116  -0.07550 -1.0 2.0
   42    33    40   116   0.20000  1.0 3.0
   42    33    40    41   0.15000  1.0 3.0
   42    33    40    48   0.62750  1.0 1.0
   42    33    40    48  -0.30950 -1.0 2.0
   42    33    40    48   0.27300  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
   71    78    77    82   1.10000 -1.0 2.0
   89    83    82    77   1.10000 -1.0 2.0
   82    90    89    91   1.10000 -1.0 2.0
   92    95    91    89   1.10000 -1.0 2.0
  100   113    99    92   4.00000 -1.0 2.0
  102   101   100    99   1.10000 -1.0 2.0
  103   105   102   100   4.00000 -1.0 2.0
  106   104   103   102   4.00000 -1.0 2.0
  113   115   106   103   4.00000 -1.0 2.0
  106   114   113    99   1.10000 -1.0 2.0
  109   107   105   102   1.00000 -1.0 2.0
  105   116   107   108  10.50000 -1.0 2.0
   48    60    51    52  10.50000 -1.0 2.0
   74    80    73    62   1.00000 -1.0 2.0
   73    88    80    81  10.50000 -1.0 2.0
END
