* LIGAND DATABASE FILE (OPLS2005)
*
001     127   129    236    365     700
    1     0 S   NP   _N1_     1    29.64495    96.74611   -25.87658
    2     1 S   H    _HN1     2     1.02947    59.76895    12.27960
    3     1 S   H    _H1_     3     1.02827    47.46172  -172.46199
    4     1 S   H    _H2_     4     1.02794   118.18991   -83.54919
    5     1 S   CT   _CA1     5     1.50133   129.20334   104.89991
    6     5 S   HC   _HA1     6     1.09573   105.16085   110.70679
    7     5 S   CO3  _C1_     7     1.53776   112.42498    -9.50713
    8     7 S   O2Z  _O11     8     1.26381   115.00411   -43.08061
    9     7 S   O2Z  _O12     9     1.26232   114.94612   135.87912
   10     5 S   CT   _CB1    10     1.53054   107.39707  -131.32061
   11    10 S   HC   HB11    11     1.09842   109.35808   -49.13868
   12    10 S   HC   HB12    12     1.09810   110.47310    67.46434
   13    10 S   CT   _CG1    13     1.53017   112.62860  -170.05139
   14    13 S   HC   HG11    14     1.09570   110.74265   -67.01634
   15    13 S   HC   HG12    15     1.09669   109.69522    52.23365
   16    13 S   C    _CD1    16     1.51816   111.95740   172.74464
   17    16 S   O    _OE1    17     1.22760   123.16041    12.75439
   18    16 S   N    _N2_    18     1.38625   111.83468  -167.28746
   19    18 S   H    _HN2    19     1.01581   119.08966     0.85134
   20    18 S   CT1  _CA2    20     1.46204   123.39556   177.18436
   21    20 S   HC   _HA2    21     1.09720   109.20874    10.36861
   22    20 S   C    _C2_    22     1.53815   109.68032  -105.61277
   23    22 S   O    _O2_    23     1.23138   122.00977  -154.71379
   24    20 S   CT   _CB2    32     1.53382   111.41374   132.37779
   25    24 S   HC   HB21    33     1.09489   109.28975    58.62202
   26    24 S   HC   HB22    34     1.09480   109.57442   177.04925
   27    22 S   N    _N3_    24     1.38207   114.29060    32.43150
   28    27 S   H    _HN3    25     1.01523   119.63751    -3.17169
   29    24 S   S    _SG2    35     1.83450   111.61313   -63.85988
   30    27 S   CT   _CA3    26     1.45272   123.23182   177.53248
   31    30 S   HC   HA31    27     1.09548   107.56373   -64.01345
   32    30 S   HC   HA32    28     1.09567   107.94284    52.42489
   33    29 S   CT   _C20    36     1.91564   102.61689   159.46724
   34    33 S   OM   _O36    37     1.32226   106.35486   -63.54334
   35    30 S   CO3  _C3_    29     1.52965   114.05164   174.44325
   36    35 S   O2Z  _O31    30     1.26384   116.09772     1.31537
   37    35 S   O2Z  _O32    31     1.26427   114.40619  -178.64853
   38    33 S   CT   _C15    38     1.56333   107.93979    54.39448
   39    38 S   HC   _H3_    39     1.09660   108.33559   -49.51837
   40    38 S   CO4  _C16    40     1.52172   108.98256    65.10341
   41    40 S   O    _O35    41     1.23137   121.04765  -141.51049
   42    38 S   CT   _C14    67     1.55328   118.21176  -170.62728
   43    42 S   HC   _H14    68     1.09619   111.74764    36.17341
   44    42 S   HC   _H15    69     1.09394   110.80027   -81.38591
   45    40 S   CM   _C17    42     1.48858   118.77209    40.15961
   46    42 S   CA   _C12    70     1.52566   111.86431   156.68639
   47    45 S   CM   _C18    43     1.34639   121.16951   -10.90779
   48    45 S   CO4  _C23    55     1.49727   120.37373   167.05323
   49    48 S   O    _O38    56     1.22954   120.66400   124.36387
   50    46 S   CA   _C13    71     1.40571   120.14278   -74.33072
   51    33 S   CT   _C19    44     1.60849   109.60222   177.18117
   52    47 S   OH   _O37    53     1.39249   118.75884   175.47870
   53    52 S   HO   _H22    54     0.96953   109.41233  -171.91391
   54    48 S   CT   _C24    57     1.51906   116.58070   -54.56665
   55    54 S   HC   _H23    58     1.09491   108.56903    78.74078
   56    54 S   HC   _H24    59     1.09544   108.45909   -39.30256
   57    50 S   CA   _C8_    72     1.39862   120.72755   175.14917
   58    50 S   OH   _O34   126     1.37105   117.48729    -5.28298
   59    58 S   HO   _H13   127     0.97056   109.99860  -162.07251
   60    51 S   CT   _C21    45     1.55939   113.52574   162.95913
   61    60 S   HC   _H16    46     1.09550   111.92863   -58.81395
   62    60 S   HC   _H17    47     1.09715   111.45129  -177.38910
   63    60 S   HC   _H18    48     1.08999   113.09250    63.52753
   64    51 S   CT   _C22    49     1.56489   111.31588    44.27081
   65    64 S   HC   _H19    50     1.09574   111.63865    46.88717
   66    64 S   HC   _H20    51     1.09540   112.27712   -75.13898
   67    64 S   HC   _H21    52     1.09653   112.03554   165.44201
   68    54 S   CT   _C25    60     1.52651   112.08435  -159.89290
   69    68 S   HC   _H25    61     1.09655   109.88136    57.61209
   70    68 S   HC   _H26    62     1.09648   110.08435   -59.74352
   71    57 S   CA   _C9_    73     1.40223   119.75620     3.82336
   72    57 S   CO4  _C7_   114     1.47994   120.98781  -173.69765
   73    72 S   O    _O33   115     1.22721   118.72243  -124.69482
   74    68 S   CT   _C26    63     1.52014   111.37063   179.05126
   75    74 S   HC   _H27    64     1.09468   110.92379    60.70873
   76    74 S   HC   _H28    65     1.09443   110.28155  -179.60091
   77    74 S   HC   _H29    66     1.09470   111.04866   -59.78464
   78    71 S   CA   _C10    74     1.40727   121.03254    -2.60722
   79    71 S   OH   _O44   112     1.37347   121.15458   178.57976
   80    79 S   HO   _H46   113     0.97313   109.50280   -12.84222
   81    72 S   CT   _C6_   116     1.51816   117.77346    59.83937
   82    81 S   HC   _H11   117     1.09642   107.37038    98.49288
   83    81 S   HC   _H12   118     1.09483   110.67148   -18.02821
   84    46 S   CA   _C11    75     1.40910   121.26900   103.39823
   85    78 S   CT   _C27    78     1.51697   120.17948  -177.82444
   86    85 S   HC   _H31    79     1.09800   108.77407  -137.20963
   87    85 S   HC   _H32    80     1.09596   109.94170   -24.46907
   88    81 S   CT   _C5_   119     1.52555   111.21567  -140.65337
   89    88 S   HC   _H9_   120     1.09632   110.06626    55.19151
   90    88 S   HC   _H10   121     1.09651   109.94475   -62.01519
   91    84 S   OH   _O39    76     1.37263   116.88989     2.43566
   92    91 S   HO   _H30    77     0.96891   110.98200  -175.50407
   93    85 S   CT   _C28    81     1.53654   112.74246    99.31402
   94    93 S   HC   _H4_    82     1.09923   110.56093    46.44135
   95    88 S   CT   _C4_   122     1.51998   111.52279   176.66875
   96    95 S   HC   _H6_   123     1.09462   111.04951    59.04959
   97    95 S   HC   _H7_   124     1.09450   110.94581   -61.51767
   98    95 S   HC   _H8_   125     1.09447   110.27549   178.87988
   99    93 S   CO4  _C29    83     1.51123   111.76535   -71.03416
  100    99 S   O    _O40    84     1.23172   120.59336    95.08215
  101    99 S   CT   _C30    85     1.51205   117.17287   -80.65328
  102   101 S   HC   _H5_    86     1.09689   107.47502    66.20881
  103   101 S   CO4  _C31    87     1.51819   111.79995   -49.35651
  104   103 S   O    _O41    88     1.23363   120.85186  -143.96848
  105   101 S   CO4  _C36   100     1.52728   111.23780  -177.21098
  106   105 S   O    _O43   101     1.23089   121.61438    83.26855
  107   103 S   CT   _C32    89     1.53213   117.96206    43.08158
  108   105 S   CT   _C37   102     1.52134   116.05852   -94.21737
  109   108 S   HC   _H39   103     1.09544   107.94377    56.98429
  110   108 S   HC   _H40   104     1.09563   107.90818   -60.24896
  111    93 S   CO4  _C33    90     1.51477   109.86267   162.11996
  112   111 S   O    _O42    91     1.23561   118.86556   -80.95066
  113   107 S   CT   _C34    92     1.54083   108.37425  -153.24038
  114   113 S   HC   _H33    93     1.09611   111.77737  -177.42283
  115   113 S   HC   _H34    94     1.09654   110.78803    62.65012
  116   113 S   HC   _H35    95     1.09608   111.82222   -57.28943
  117   107 S   CT   _C35    96     1.53368   107.92253    88.52295
  118   117 S   HC   _H36    97     1.09595   111.41885  -179.03571
  119   117 S   HC   _H37    98     1.09621   111.23520    60.45008
  120   117 S   HC   _H38    99     1.09482   111.66223   -58.97357
  121   108 S   CT   _C38   105     1.52551   112.62490   178.29567
  122   121 S   HC   _H41   106     1.09657   109.96177   -58.22880
  123   121 S   HC   _H42   107     1.09652   109.95615    59.10610
  124   121 S   CT   _C39   108     1.51995   111.44624  -179.50663
  125   124 S   HC   _H43   109     1.09468   110.99812   -60.26993
  126   124 S   HC   _H44   110     1.09447   110.26978   179.97202
  127   124 S   HC   _H45   111     1.09478   110.99116    60.23759
  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
  21   8   2   1   1  15   8  12   4  11   4   3  12  11  14  10
   4  11  10   3   1   9   5   4  14   4   1   7   3   2   1   3
   2   1   1   6   5   4  12  10   4   3   2   1   1  12   3   1
   9   5   4   6  11   5   4   6   5   4   1   1  12   6   3   2
   1   1  11   5  13   6  15   5   9   4  10   9   5   4   9   2
   7   3   2   1   3   2   1   1   6   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    51    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    47    51    60    64    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    45    47    51    60    61    62    63    64    65    66    67    52    42    43    44    46  
   38    39    40    47    51    60    64    42  
   36    37  
   37  
    0  
   39    40    41    45    47    51    60    64    48    42    43    44    46    50    84  
   40    41    45    51    42    43    44    46  
   41    45    47    51    52    48    49    54    42    43    44    46  
   45    47    48    42  
   43    44    46    50    57    78    84    91    58    45    51  
   44    46    50    84  
   46    50    84  
   47    51    60    64    52    53    48    49    54    55    56    68  
   50    57    71    78    84    91    92    85    72    58    59  
   51    60    61    62    63    64    65    66    67    52    53    48    49    54  
   49    54    55    56    68    69    70    74    51    52  
   54    55    56    68  
   57    71    78    84    91    79    72    73    81    58    59  
   60    61    62    63    64    65    66    67    52    53  
   53    60    64  
    0  
   55    56    68    69    70    74    75    76    77  
   56    68    69    70    74  
   68    69    70    74  
   71    78    84    85    79    80    72    73    81    82    83    88    58    59  
   59    71    72    84  
    0  
   61    62    63    64    65    66    67  
   62    63    64  
   63    64  
   64  
   65    66    67  
   66    67  
   67  
    0  
   69    70    74    75    76    77  
   70    74    75    76    77  
   74    75    76    77  
   78    84    91    85    86    87    93    79    80    72    73    81  
   73    81    82    83    88    89    90    95    78    79  
   81    82    83    88  
   75    76    77  
   76    77  
   77  
    0  
   84    91    92    85    86    87    93    94    99   111    79    80  
   80    84    85  
    0  
   82    83    88    89    90    95    96    97    98  
   83    88    89    90    95  
   88    89    90    95  
   91    92    85    86    87    93  
   86    87    93    94    99   100   101   107   111   112    91  
   87    93    94    99   111  
   93    94    99   111  
   89    90    95    96    97    98  
   90    95    96    97    98  
   95    96    97    98  
   92  
    0  
   94    99   100   101   102   103   107   111   112   113   117   105  
   99   100   101   107   111   112  
   96    97    98  
   97    98  
   98  
    0  
  100   101   102   103   104   107   111   112   105   106   108  
  101   102   103   111   105  
  102   103   104   107   111   113   117   105   106   108   109   110   121  
  103   104   107   105   106   108  
  104   107   111   112   113   114   115   116   117   118   119   120   105   106   108  
  107   111   113   117   105  
  106   108   109   110   121   122   123   124   107  
  108   109   110   121  
  111   112   113   114   115   116   117   118   119   120  
  109   110   121   122   123   124   125   126   127  
  110   121   122   123   124  
  121   122   123   124  
  112   113   114   115   116   117   118   119   120  
  113   117  
  114   115   116   117   118   119   120  
  115   116   117  
  116   117  
  117  
  118   119   120  
  119   120  
  120  
    0  
  122   123   124   125   126   127  
  123   124   125   126   127  
  124   125   126   127  
  125   126   127  
  126   127  
  127  
    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  -0.175000   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   4.2000   0.3000  -0.012500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   40   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   42   3.5000   0.0660  -0.005000   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   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   46   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   48   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   49   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   50   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   51   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   52   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   53   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   54   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   56   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   57   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   58   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   59   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   60   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   72   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   73   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   74   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   79   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   80   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   81   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   83   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   84   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   85   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   92   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   93   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   94   2.4200   0.0150   0.060000   1.3810   1.2100   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   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
  100   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
  101   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
  102   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  103   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
  104   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
  105   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
  106   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
  107   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
  108   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  109   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
  112   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
  113   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  114   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  115   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  116   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  117   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  118   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  119   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  120   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  121   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  122   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  123   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  124   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  125   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  126   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  127   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   570.000  1.307
   33    38   268.000  1.529
   33    51   268.000  1.529
   38    39   340.000  1.090
   38    40   317.000  1.522
   38    42   268.000  1.529
   40    41   570.000  1.229
   40    45   320.000  1.462
   45    47   549.000  1.340
   45    48   320.000  1.462
   47    51   317.000  1.510
   47    52   510.000  1.338
   51    60   268.000  1.529
   51    64   268.000  1.529
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   340.000  1.090
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   340.000  1.090
   52    53   553.000  0.945
   48    49   570.000  1.229
   48    54   317.000  1.522
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    68   268.000  1.529
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    74   268.000  1.529
   74    75   340.000  1.090
   74    76   340.000  1.090
   74    77   340.000  1.090
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    46   317.000  1.510
   46    50   469.000  1.400
   46    84   469.000  1.400
   50    57   469.000  1.400
   50    58   450.000  1.364
   57    71   469.000  1.400
   57    72   310.000  1.470
   71    78   469.000  1.400
   71    79   450.000  1.364
   78    84   469.000  1.400
   78    85   317.000  1.510
   84    91   450.000  1.364
   91    92   553.000  0.945
   85    86   340.000  1.090
   85    87   340.000  1.090
   85    93   268.000  1.529
   93    94   340.000  1.090
   93    99   317.000  1.522
   93   111   317.000  1.522
   99   100   570.000  1.229
   99   101   317.000  1.522
  101   102   340.000  1.090
  101   103   317.000  1.522
  101   105   317.000  1.522
  103   104   570.000  1.229
  103   107   317.000  1.522
  107   111   317.000  1.522
  107   113   268.000  1.529
  107   117   268.000  1.529
  111   112   570.000  1.229
  113   114   340.000  1.090
  113   115   340.000  1.090
  113   116   340.000  1.090
  117   118   340.000  1.090
  117   119   340.000  1.090
  117   120   340.000  1.090
  105   106   570.000  1.229
  105   108   317.000  1.522
  108   109   340.000  1.090
  108   110   340.000  1.090
  108   121   268.000  1.529
  121   122   340.000  1.090
  121   123   340.000  1.090
  121   124   268.000  1.529
  124   125   340.000  1.090
  124   126   340.000  1.090
  124   127   340.000  1.090
   79    80   553.000  0.945
   72    73   570.000  1.229
   72    81   317.000  1.522
   81    82   340.000  1.090
   81    83   340.000  1.090
   81    88   268.000  1.529
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    95   268.000  1.529
   95    96   340.000  1.090
   95    97   340.000  1.090
   95    98   340.000  1.090
   58    59   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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    85.00000  114.68000
   29    33    38    75.00000  111.63000
   29    33    51    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    63.00000  111.10000
   33    38    42    58.35000  112.70000
   33    51    47    70.00000  112.02700
   33    51    60    58.35000  112.70000
   33    51    64    58.35000  112.70000
   38    33    34    50.00000  109.50000
   38    40    41    80.00000  120.40000
   38    40    45    65.00000  118.62400
   38    42    43    37.50000  110.70000
   38    42    44    37.50000  110.70000
   38    42    46    70.00000  112.17500
   40    38    39    35.00000  109.50000
   40    45    47    65.00000  118.96000
   40    45    48    65.00000  115.30000
   45    40    41    80.00000  123.72100
   45    47    51    70.00000  124.00000
   45    47    52    80.00000  121.38400
   45    48    49    80.00000  123.72100
   45    48    54    65.00000  118.62400
   47    51    60    70.00000  112.02700
   47    51    64    70.00000  112.02700
   47    52    53    70.00000  107.45700
   51    33    34    50.00000  109.50000
   51    33    38    58.35000  112.70000
   51    60    61    37.50000  110.70000
   51    60    62    37.50000  110.70000
   51    60    63    37.50000  110.70000
   51    64    65    37.50000  110.70000
   51    64    66    37.50000  110.70000
   51    64    67    37.50000  110.70000
   62    60    61    33.00000  107.80000
   63    60    61    33.00000  107.80000
   63    60    62    33.00000  107.80000
   64    51    60    58.35000  112.70000
   66    64    65    33.00000  107.80000
   67    64    65    33.00000  107.80000
   67    64    66    33.00000  107.80000
   52    47    51    90.00000  109.34000
   48    45    47    65.00000  118.96000
   48    54    55    35.00000  109.50000
   48    54    56    35.00000  109.50000
   48    54    68    63.00000  111.10000
   54    48    49    80.00000  120.40000
   54    68    69    37.50000  110.70000
   54    68    70    37.50000  110.70000
   54    68    74    58.35000  112.70000
   56    54    55    33.00000  107.80000
   68    54    55    37.50000  110.70000
   68    54    56    37.50000  110.70000
   68    74    75    37.50000  110.70000
   68    74    76    37.50000  110.70000
   68    74    77    37.50000  110.70000
   70    68    69    33.00000  107.80000
   74    68    69    37.50000  110.70000
   74    68    70    37.50000  110.70000
   76    74    75    33.00000  107.80000
   77    74    75    33.00000  107.80000
   77    74    76    33.00000  107.80000
   42    38    39    37.50000  110.70000
   42    38    40    63.00000  111.10000
   42    46    50    70.00000  120.00000
   42    46    84    70.00000  120.00000
   44    42    43    33.00000  107.80000
   46    42    43    35.00000  109.50000
   46    42    44    35.00000  109.50000
   46    50    57    63.00000  120.00000
   46    50    58    70.00000  120.00000
   46    84    78    63.00000  120.00000
   46    84    91    70.00000  120.00000
   50    57    71    63.00000  120.00000
   50    57    72    60.00000  119.52600
   50    58    59    35.00000  113.00000
   57    71    78    63.00000  120.00000
   57    71    79    70.00000  120.00000
   57    72    73    75.00000  123.78400
   57    72    81    65.00000  115.47100
   71    78    84    63.00000  120.00000
   71    78    85    70.00000  120.00000
   71    79    80    35.00000  113.00000
   78    84    91    70.00000  120.00000
   78    85    86    35.00000  109.50000
   78    85    87    35.00000  109.50000
   78    85    93    70.00000  112.17500
   84    46    50    63.00000  120.00000
   84    91    92    35.00000  113.00000
   85    78    84    70.00000  120.00000
   85    93    94    37.50000  110.70000
   85    93    99    63.00000  111.10000
   85    93   111    63.00000  111.10000
   87    85    86    33.00000  107.80000
   93    85    86    37.50000  110.70000
   93    85    87    37.50000  110.70000
   93    99   100    80.00000  120.40000
   93    99   101    70.00000  116.00000
   93   111   107    70.00000  116.00000
   93   111   112    80.00000  120.40000
   99    93    94    35.00000  109.50000
   99   101   102    35.00000  109.50000
   99   101   103    75.00000  107.99600
   99   101   105    75.00000  107.99600
  101    99   100    80.00000  120.40000
  101   103   104    80.00000  120.40000
  101   103   107    70.00000  116.00000
  101   105   106    80.00000  120.40000
  101   105   108    70.00000  116.00000
  103   101   102    35.00000  109.50000
  103   107   111    75.00000  107.99600
  103   107   113    63.00000  111.10000
  103   107   117    63.00000  111.10000
  107   103   104    80.00000  120.40000
  107   111   112    80.00000  120.40000
  107   113   114    37.50000  110.70000
  107   113   115    37.50000  110.70000
  107   113   116    37.50000  110.70000
  107   117   118    37.50000  110.70000
  107   117   119    37.50000  110.70000
  107   117   120    37.50000  110.70000
  111    93    94    35.00000  109.50000
  111    93    99    75.00000  107.99600
  113   107   111    63.00000  111.10000
  115   113   114    33.00000  107.80000
  116   113   114    33.00000  107.80000
  116   113   115    33.00000  107.80000
  117   107   111    63.00000  111.10000
  117   107   113    58.35000  112.70000
  119   117   118    33.00000  107.80000
  120   117   118    33.00000  107.80000
  120   117   119    33.00000  107.80000
  105   101   102    35.00000  109.50000
  105   101   103    75.00000  107.99600
  105   108   109    35.00000  109.50000
  105   108   110    35.00000  109.50000
  105   108   121    63.00000  111.10000
  108   105   106    80.00000  120.40000
  108   121   122    37.50000  110.70000
  108   121   123    37.50000  110.70000
  108   121   124    58.35000  112.70000
  110   108   109    33.00000  107.80000
  121   108   109    37.50000  110.70000
  121   108   110    37.50000  110.70000
  121   124   125    37.50000  110.70000
  121   124   126    37.50000  110.70000
  121   124   127    37.50000  110.70000
  123   121   122    33.00000  107.80000
  124   121   122    37.50000  110.70000
  124   121   123    37.50000  110.70000
  126   124   125    33.00000  107.80000
  127   124   125    33.00000  107.80000
  127   124   126    33.00000  107.80000
   79    71    78    70.00000  120.00000
   72    57    71    60.00000  119.52600
   72    81    82    35.00000  109.50000
   72    81    83    35.00000  109.50000
   72    81    88    63.00000  111.10000
   81    72    73    80.00000  120.40000
   81    88    89    37.50000  110.70000
   81    88    90    37.50000  110.70000
   81    88    95    58.35000  112.70000
   83    81    82    33.00000  107.80000
   88    81    82    37.50000  110.70000
   88    81    83    37.50000  110.70000
   88    95    96    37.50000  110.70000
   88    95    97    37.50000  110.70000
   88    95    98    37.50000  110.70000
   90    88    89    33.00000  107.80000
   95    88    89    37.50000  110.70000
   95    88    90    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
   58    50    57    70.00000  120.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.13850  1.0 1.0
   24    29    33    34  -1.34450 -1.0 2.0
   24    29    33    34   0.57400  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    51   0.01700  1.0 1.0
   24    29    33    51  -0.23550 -1.0 2.0
   24    29    33    51   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.56750  1.0 1.0
   29    33    38    40  -0.07550 -1.0 2.0
   29    33    38    40   0.20000  1.0 3.0
   29    33    38    42   0.44750  1.0 1.0
   29    33    38    42  -0.17800 -1.0 2.0
   29    33    38    42   0.20200  1.0 3.0
   29    33    51    47   0.56750  1.0 1.0
   29    33    51    47  -0.07550 -1.0 2.0
   29    33    51    47   0.20000  1.0 3.0
   29    33    51    60   0.44750  1.0 1.0
   29    33    51    60  -0.17800 -1.0 2.0
   29    33    51    60   0.20200  1.0 3.0
   29    33    51    64   0.44750  1.0 1.0
   29    33    51    64  -0.17800 -1.0 2.0
   29    33    51    64   0.20200  1.0 3.0
   33    38    40    41   0.30150 -1.0 2.0
   33    38    40    45   0.65300  1.0 1.0
   33    38    40    45  -0.03850 -1.0 2.0
   33    38    40    45   0.33900  1.0 3.0
   33    38    42    43   0.15000  1.0 3.0
   33    38    42    44   0.15000  1.0 3.0
   33    38    42    46  -0.03700  1.0 1.0
   33    38    42    46   0.37200 -1.0 2.0
   33    38    42    46  -0.47300  1.0 3.0
   33    51    60    61   0.15000  1.0 3.0
   33    51    60    62   0.15000  1.0 3.0
   33    51    60    63   0.15000  1.0 3.0
   33    51    64    65   0.15000  1.0 3.0
   33    51    64    66   0.15000  1.0 3.0
   33    51    64    67   0.15000  1.0 3.0
   34    33    38    39   0.23400  1.0 3.0
   34    33    38    40  -0.09450  1.0 1.0
   34    33    38    40  -1.12950 -1.0 2.0
   34    33    38    40   0.54000  1.0 3.0
   34    33    38    42   0.62750  1.0 1.0
   34    33    38    42  -0.30950 -1.0 2.0
   34    33    38    42   0.27300  1.0 3.0
   34    33    51    47   0.61850  1.0 1.0
   34    33    51    47  -0.22750 -1.0 2.0
   34    33    51    47   0.15300  1.0 3.0
   34    33    51    60   0.62750  1.0 1.0
   34    33    51    60  -0.30950 -1.0 2.0
   34    33    51    60   0.27300  1.0 3.0
   34    33    51    64   0.62750  1.0 1.0
   34    33    51    64  -0.30950 -1.0 2.0
   34    33    51    64   0.27300  1.0 3.0
   38    33    51    47   0.34400  1.0 1.0
   38    33    51    47   0.09450 -1.0 2.0
   38    33    51    47   0.11100  1.0 3.0
   38    33    51    60   0.56750  1.0 1.0
   38    33    51    60  -0.07550 -1.0 2.0
   38    33    51    60   0.20000  1.0 3.0
   38    33    51    64   0.56750  1.0 1.0
   38    33    51    64  -0.07550 -1.0 2.0
   38    33    51    64   0.20000  1.0 3.0
   38    40   -45    47  -0.33500  1.0 1.0
   38    40   -45    47   1.06600 -1.0 2.0
   38    40   -45    47  -0.14000  1.0 3.0
   38    40    45    48   1.50000 -1.0 2.0
   38    42    46    50   0.04150 -1.0 2.0
   38    42    46    84   0.04150 -1.0 2.0
   39    38    40    41   0.00000  1.0 1.0
   39    38    40    45   0.00000  1.0 1.0
   39    38    42    43   0.15000  1.0 3.0
   39    38    42    44   0.15000  1.0 3.0
   39    38    42    46   0.43200  1.0 3.0
   40    38    42    43  -0.11250  1.0 3.0
   40    38    42    44  -0.11250  1.0 3.0
   40    38    42    46   0.56750  1.0 1.0
   40    38    42    46  -0.07550 -1.0 2.0
   40    38    42    46   0.20000  1.0 3.0
   40    45    47    51   7.00000 -1.0 2.0
   40    45    47    52   7.00000 -1.0 2.0
   40    45    48    49   2.50000 -1.0 2.0
   40    45    48    54   1.50000 -1.0 2.0
   41    40    45    47   1.00000 -1.0 2.0
   41    40    45    48   2.50000 -1.0 2.0
   45    47   -51    33   0.09850  1.0 1.0
   45    47   -51    33   0.15250 -1.0 2.0
   45    47   -51    33  -0.50650  1.0 3.0
   45    47    51    60   0.09850  1.0 1.0
   45    47    51    60   0.15250 -1.0 2.0
   45    47    51    60  -0.50650  1.0 3.0
   45    47    51    64   0.09850  1.0 1.0
   45    47    51    64   0.15250 -1.0 2.0
   45    47    51    64  -0.50650  1.0 3.0
   45    47    52    53  -0.66100  1.0 1.0
   45    47    52    53   1.20850 -1.0 2.0
   45    47    52    53  -0.36000  1.0 3.0
   45    48    54    55   0.00000  1.0 1.0
   45    48    54    56   0.00000  1.0 1.0
   45    48    54    68   0.65300  1.0 1.0
   45    48    54    68  -0.03850 -1.0 2.0
   45    48    54    68   0.33900  1.0 3.0
   47    45    48    49   1.00000 -1.0 2.0
   47    45    48    54  -0.33500  1.0 1.0
   47    45    48    54   1.06600 -1.0 2.0
   47    45    48    54  -0.14000  1.0 3.0
   47    51    60    61   0.15000  1.0 3.0
   47    51    60    62   0.15000  1.0 3.0
   47    51    60    63   0.15000  1.0 3.0
   47    51    64    65   0.15000  1.0 3.0
   47    51    64    66   0.15000  1.0 3.0
   47    51    64    67   0.15000  1.0 3.0
   51    33    38    39   0.15000  1.0 3.0
   51    33   -38    40  -0.95700  1.0 1.0
   51    33   -38    40  -0.18200 -1.0 2.0
   51    33   -38    40   0.29450  1.0 3.0
   51    33    38    42   0.56750  1.0 1.0
   51    33    38    42  -0.07550 -1.0 2.0
   51    33    38    42   0.20000  1.0 3.0
   51    47    52    53   2.00000 -1.0 2.0
   60    51    64    65   0.15000  1.0 3.0
   60    51    64    66   0.15000  1.0 3.0
   60    51    64    67   0.15000  1.0 3.0
   64    51    60    61   0.15000  1.0 3.0
   64    51    60    62   0.15000  1.0 3.0
   64    51    60    63   0.15000  1.0 3.0
   52    47    51    33   0.09700  1.0 1.0
   52    47    51    33   0.15600 -1.0 2.0
   52    47    51    33  -0.50800  1.0 3.0
   52    47    51    60   0.09700  1.0 1.0
   52    47    51    60   0.15600 -1.0 2.0
   52    47    51    60  -0.50800  1.0 3.0
   52    47    51    64   0.09700  1.0 1.0
   52    47    51    64   0.15600 -1.0 2.0
   52    47    51    64  -0.50800  1.0 3.0
   48    45    47    51   7.00000 -1.0 2.0
   48    45    47    52   7.00000 -1.0 2.0
   48    54    68    69  -0.11250  1.0 3.0
   48    54    68    70  -0.11250  1.0 3.0
   48    54    68    74  -0.95700  1.0 1.0
   48    54    68    74  -0.18200 -1.0 2.0
   48    54    68    74   0.29450  1.0 3.0
   49    48    54    55   0.00000  1.0 1.0
   49    48    54    56   0.00000  1.0 1.0
   49    48    54    68   0.30150 -1.0 2.0
   54    68    74    75   0.15000  1.0 3.0
   54    68    74    76   0.15000  1.0 3.0
   54    68    74    77   0.15000  1.0 3.0
   55    54    68    69   0.15000  1.0 3.0
   55    54    68    70   0.15000  1.0 3.0
   55    54    68    74   0.15000  1.0 3.0
   56    54    68    69   0.15000  1.0 3.0
   56    54    68    70   0.15000  1.0 3.0
   56    54    68    74   0.15000  1.0 3.0
   69    68    74    75   0.15000  1.0 3.0
   69    68    74    76   0.15000  1.0 3.0
   69    68    74    77   0.15000  1.0 3.0
   70    68    74    75   0.15000  1.0 3.0
   70    68    74    76   0.15000  1.0 3.0
   70    68    74    77   0.15000  1.0 3.0
   42    38    40    41   0.30150 -1.0 2.0
   42    38    40    45   0.65300  1.0 1.0
   42    38    40    45  -0.03850 -1.0 2.0
   42    38    40    45   0.33900  1.0 3.0
   42    46    50    57   3.62500 -1.0 2.0
   42    46    50    58   3.62500 -1.0 2.0
   42    46    84    78   3.62500 -1.0 2.0
   42    46    84    91   3.62500 -1.0 2.0
   43    42    46    50   0.00000  1.0 1.0
   43    42    46    84   0.00000  1.0 1.0
   44    42    46    50   0.00000  1.0 1.0
   44    42    46    84   0.00000  1.0 1.0
   46    50    57    71   3.62500 -1.0 2.0
   46    50    57    72   3.62500 -1.0 2.0
   46    50    58    59   0.84100 -1.0 2.0
   46    84    91    92   0.84100 -1.0 2.0
   50    46    84    78   3.62500 -1.0 2.0
   50    46    84    91   3.62500 -1.0 2.0
   50    57   -71    78   3.62500 -1.0 2.0
   50    57    71    79   3.62500 -1.0 2.0
   50    57    72    73   1.05000 -1.0 2.0
   50    57    72    81   2.26350  1.0 1.0
   50    57    72    81   0.76750 -1.0 2.0
   50    57    72    81   0.22500  1.0 3.0
   57    50    58    59   0.84100 -1.0 2.0
   57    71    78    84   3.62500 -1.0 2.0
   57    71    78    85   3.62500 -1.0 2.0
   57    71    79    80   0.84100 -1.0 2.0
   57    72    81    82   0.00000  1.0 1.0
   57    72    81    83   0.00000  1.0 1.0
   57    72    81    88   0.05850 -1.0 2.0
   57    72    81    88   0.17250  1.0 3.0
   71    57    72    73   1.05000 -1.0 2.0
   71    57    72    81   2.26350  1.0 1.0
   71    57    72    81   0.76750 -1.0 2.0
   71    57    72    81   0.22500  1.0 3.0
   71    78   -84    46   3.62500 -1.0 2.0
   71    78    84    91   3.62500 -1.0 2.0
   71    78    85    86   0.00000  1.0 1.0
   71    78    85    87   0.00000  1.0 1.0
   71    78    85    93   0.04150 -1.0 2.0
   78    71    79    80   0.84100 -1.0 2.0
   78    84    91    92   0.84100 -1.0 2.0
   78    85    93    94   0.43200  1.0 3.0
   78    85    93    99   0.56750  1.0 1.0
   78    85    93    99  -0.07550 -1.0 2.0
   78    85    93    99   0.20000  1.0 3.0
   78    85    93   111   0.56750  1.0 1.0
   78    85    93   111  -0.07550 -1.0 2.0
   78    85    93   111   0.20000  1.0 3.0
   84    46   -50    57   3.62500 -1.0 2.0
   84    46    50    58   3.62500 -1.0 2.0
   84    78    85    86   0.00000  1.0 1.0
   84    78    85    87   0.00000  1.0 1.0
   84    78    85    93   0.04150 -1.0 2.0
   85    78    84    46   3.62500 -1.0 2.0
   85    78    84    91   3.62500 -1.0 2.0
   85    93    99   100   0.30150 -1.0 2.0
   85    93    99   101   0.60050  1.0 1.0
   85    93    99   101   0.05600 -1.0 2.0
   85    93    99   101   0.26150  1.0 3.0
   85    93   111   107   0.60050  1.0 1.0
   85    93   111   107   0.05600 -1.0 2.0
   85    93   111   107   0.26150  1.0 3.0
   85    93   111   112   0.30150 -1.0 2.0
   86    85    93    94   0.15000  1.0 3.0
   86    85    93    99  -0.11250  1.0 3.0
   86    85    93   111  -0.11250  1.0 3.0
   87    85    93    94   0.15000  1.0 3.0
   87    85    93    99  -0.11250  1.0 3.0
   87    85    93   111  -0.11250  1.0 3.0
   93    99   101   102   0.00000  1.0 1.0
   93    99   101   103   0.65300  1.0 1.0
   93    99   101   103  -0.03850 -1.0 2.0
   93    99   101   103   0.33900  1.0 3.0
   93    99   101   105   0.65300  1.0 1.0
   93    99   101   105  -0.03850 -1.0 2.0
   93    99   101   105   0.33900  1.0 3.0
   94    93    99   100   0.00000  1.0 1.0
   94    93    99   101   0.00000  1.0 1.0
   94    93   111   107   0.00000  1.0 1.0
   94    93   111   112   0.00000  1.0 1.0
   99    93   111   107   0.65300  1.0 1.0
   99    93   111   107  -0.03850 -1.0 2.0
   99    93   111   107   0.33900  1.0 3.0
   99    93   111   112   0.30150 -1.0 2.0
   99   101   103   104   0.30150 -1.0 2.0
   99   101  -103   107   0.65300  1.0 1.0
   99   101  -103   107  -0.03850 -1.0 2.0
   99   101  -103   107   0.33900  1.0 3.0
   99   101   105   106   0.30150 -1.0 2.0
   99   101   105   108   0.65300  1.0 1.0
   99   101   105   108  -0.03850 -1.0 2.0
   99   101   105   108   0.33900  1.0 3.0
  100    99   101   102   0.00000  1.0 1.0
  100    99   101   103   0.30150 -1.0 2.0
  100    99   101   105   0.30150 -1.0 2.0
  101   103   107   111   0.65300  1.0 1.0
  101   103   107   111  -0.03850 -1.0 2.0
  101   103   107   111   0.33900  1.0 3.0
  101   103   107   113   0.60050  1.0 1.0
  101   103   107   113   0.05600 -1.0 2.0
  101   103   107   113   0.26150  1.0 3.0
  101   103   107   117   0.60050  1.0 1.0
  101   103   107   117   0.05600 -1.0 2.0
  101   103   107   117   0.26150  1.0 3.0
  101   105   108   109   0.00000  1.0 1.0
  101   105   108   110   0.00000  1.0 1.0
  101   105   108   121   0.60050  1.0 1.0
  101   105   108   121   0.05600 -1.0 2.0
  101   105   108   121   0.26150  1.0 3.0
  102   101   103   104   0.00000  1.0 1.0
  102   101   103   107   0.00000  1.0 1.0
  102   101   105   106   0.00000  1.0 1.0
  102   101   105   108   0.00000  1.0 1.0
  103   101   105   106   0.30150 -1.0 2.0
  103   101   105   108   0.65300  1.0 1.0
  103   101   105   108  -0.03850 -1.0 2.0
  103   101   105   108   0.33900  1.0 3.0
  103   107  -111    93   0.65300  1.0 1.0
  103   107  -111    93  -0.03850 -1.0 2.0
  103   107  -111    93   0.33900  1.0 3.0
  103   107   111   112   0.30150 -1.0 2.0
  103   107   113   114  -0.11250  1.0 3.0
  103   107   113   115  -0.11250  1.0 3.0
  103   107   113   116  -0.11250  1.0 3.0
  103   107   117   118  -0.11250  1.0 3.0
  103   107   117   119  -0.11250  1.0 3.0
  103   107   117   120  -0.11250  1.0 3.0
  104   103   107   111   0.30150 -1.0 2.0
  104   103   107   113   0.30150 -1.0 2.0
  104   103   107   117   0.30150 -1.0 2.0
  111    93    99   100   0.30150 -1.0 2.0
  111    93   -99   101   0.65300  1.0 1.0
  111    93   -99   101  -0.03850 -1.0 2.0
  111    93   -99   101   0.33900  1.0 3.0
  111   107   113   114  -0.11250  1.0 3.0
  111   107   113   115  -0.11250  1.0 3.0
  111   107   113   116  -0.11250  1.0 3.0
  111   107   117   118  -0.11250  1.0 3.0
  111   107   117   119  -0.11250  1.0 3.0
  111   107   117   120  -0.11250  1.0 3.0
  113   107   111    93   0.60050  1.0 1.0
  113   107   111    93   0.05600 -1.0 2.0
  113   107   111    93   0.26150  1.0 3.0
  113   107   111   112   0.30150 -1.0 2.0
  113   107   117   118   0.15000  1.0 3.0
  113   107   117   119   0.15000  1.0 3.0
  113   107   117   120   0.15000  1.0 3.0
  117   107   111    93   0.60050  1.0 1.0
  117   107   111    93   0.05600 -1.0 2.0
  117   107   111    93   0.26150  1.0 3.0
  117   107   111   112   0.30150 -1.0 2.0
  117   107   113   114   0.15000  1.0 3.0
  117   107   113   115   0.15000  1.0 3.0
  117   107   113   116   0.15000  1.0 3.0
  105   101   103   104   0.30150 -1.0 2.0
  105   101   103   107   0.65300  1.0 1.0
  105   101   103   107  -0.03850 -1.0 2.0
  105   101   103   107   0.33900  1.0 3.0
  105   108   121   122  -0.11250  1.0 3.0
  105   108   121   123  -0.11250  1.0 3.0
  105   108   121   124  -0.95700  1.0 1.0
  105   108   121   124  -0.18200 -1.0 2.0
  105   108   121   124   0.29450  1.0 3.0
  106   105   108   109   0.00000  1.0 1.0
  106   105   108   110   0.00000  1.0 1.0
  106   105   108   121   0.30150 -1.0 2.0
  108   121   124   125   0.15000  1.0 3.0
  108   121   124   126   0.15000  1.0 3.0
  108   121   124   127   0.15000  1.0 3.0
  109   108   121   122   0.15000  1.0 3.0
  109   108   121   123   0.15000  1.0 3.0
  109   108   121   124   0.15000  1.0 3.0
  110   108   121   122   0.15000  1.0 3.0
  110   108   121   123   0.15000  1.0 3.0
  110   108   121   124   0.15000  1.0 3.0
  122   121   124   125   0.15000  1.0 3.0
  122   121   124   126   0.15000  1.0 3.0
  122   121   124   127   0.15000  1.0 3.0
  123   121   124   125   0.15000  1.0 3.0
  123   121   124   126   0.15000  1.0 3.0
  123   121   124   127   0.15000  1.0 3.0
   79    71    78    84   3.62500 -1.0 2.0
   79    71    78    85   3.62500 -1.0 2.0
   72    57    71    78   3.62500 -1.0 2.0
   72    57    71    79   3.62500 -1.0 2.0
   72    81    88    89  -0.11250  1.0 3.0
   72    81    88    90  -0.11250  1.0 3.0
   72    81    88    95  -0.95700  1.0 1.0
   72    81    88    95  -0.18200 -1.0 2.0
   72    81    88    95   0.29450  1.0 3.0
   73    72    81    82   0.00000  1.0 1.0
   73    72    81    83   0.00000  1.0 1.0
   73    72    81    88   0.30150 -1.0 2.0
   81    88    95    96   0.15000  1.0 3.0
   81    88    95    97   0.15000  1.0 3.0
   81    88    95    98   0.15000  1.0 3.0
   82    81    88    89   0.15000  1.0 3.0
   82    81    88    90   0.15000  1.0 3.0
   82    81    88    95   0.15000  1.0 3.0
   83    81    88    89   0.15000  1.0 3.0
   83    81    88    90   0.15000  1.0 3.0
   83    81    88    95   0.15000  1.0 3.0
   89    88    95    96   0.15000  1.0 3.0
   89    88    95    97   0.15000  1.0 3.0
   89    88    95    98   0.15000  1.0 3.0
   90    88    95    96   0.15000  1.0 3.0
   90    88    95    97   0.15000  1.0 3.0
   90    88    95    98   0.15000  1.0 3.0
   58    50    57    71   3.62500 -1.0 2.0
   58    50    57    72   3.62500 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   38    45    40    41  10.50000 -1.0 2.0
   40    48    45    47   1.10000 -1.0 2.0
   51    52    47    45   1.10000 -1.0 2.0
   45    54    48    49  10.50000 -1.0 2.0
   50    84    46    42   4.00000 -1.0 2.0
   57    58    50    46   4.00000 -1.0 2.0
   71    72    57    50   4.00000 -1.0 2.0
   78    79    71    57   4.00000 -1.0 2.0
   84    85    78    71   4.00000 -1.0 2.0
   78    91    84    46   4.00000 -1.0 2.0
   93   101    99   100  10.50000 -1.0 2.0
  101   107   103   104  10.50000 -1.0 2.0
   93   107   111   112  10.50000 -1.0 2.0
  101   108   105   106  10.50000 -1.0 2.0
   57    81    72    73  10.50000 -1.0 2.0
END
