* LIGAND DATABASE FILE (OPLS2005)
*
001     127   129    236    365     700
    1     0 S   NP   _N1_     1    29.22054    97.46003   -20.80914
    2     1 S   H    _HN1     2     1.02827    47.48582   170.56276
    3     1 S   H    _H1_     3     1.02775    87.35293   -72.01480
    4     1 S   H    _H2_     4     1.02949    73.95979    38.03207
    5     1 S   CT   _CA1     5     1.50240   155.93795   142.08016
    6     5 S   HC   _HA1     6     1.09558   105.13366    81.42398
    7     5 S   CO3  _C1_     7     1.53856   112.39847   -38.65832
    8     7 S   O2Z  _O11     8     1.26401   114.85228   -35.82772
    9     7 S   O2Z  _O12     9     1.26245   115.16318   142.85541
   10     5 S   CT   _CB1    10     1.53058   107.31838  -160.40989
   11    10 S   HC   HB11    11     1.09819   109.50902   -45.80672
   12    10 S   HC   HB12    12     1.09765   110.38192    70.85768
   13    10 S   CT   _CG1    13     1.52924   112.62577  -166.72255
   14    13 S   HC   HG11    14     1.09443   110.71447   -62.15680
   15    13 S   HC   HG12    15     1.09682   109.83838    56.65154
   16    13 S   C    _CD1    16     1.51905   112.32049   176.37415
   17    16 S   O    _OE1    17     1.22731   123.28659    -7.37821
   18    16 S   N    _N2_    18     1.38530   111.56340   174.19613
   19    18 S   H    _HN2    19     1.01592   118.82106    -2.27073
   20    18 S   CT1  _CA2    20     1.46273   123.77495   174.84558
   21    20 S   HC   _HA2    21     1.09737   109.43841    -7.05486
   22    20 S   C    _C2_    22     1.53566   108.02608  -122.09597
   23    22 S   O    _O2_    23     1.23034   122.53939  -148.31522
   24    20 S   CT   _CB2    32     1.53276   111.31883   115.59799
   25    24 S   HC   HB21    33     1.09417   109.41016    50.29058
   26    24 S   HC   HB22    34     1.09516   110.68424   168.46134
   27    22 S   N    _N3_    24     1.38437   113.49640    39.40430
   28    27 S   H    _HN3    25     1.01623   119.47064    -3.85986
   29    24 S   S    _SG2    35     1.83708   110.99352   -73.69721
   30    27 S   CT   _CA3    26     1.45268   123.10782   176.92980
   31    30 S   HC   HA31    27     1.09554   107.57211   -62.67889
   32    30 S   HC   HA32    28     1.09560   107.88782    53.71117
   33    29 S   CT   _C20    36     1.90913   102.96326   141.05116
   34    33 S   OM   _O36    37     1.32133   107.65847    45.18772
   35    30 S   CO3  _C3_    29     1.52923   114.17215   175.66903
   36    35 S   O2Z  _O31    30     1.26361   116.09291    -0.34150
   37    35 S   O2Z  _O32    31     1.26436   114.39908   179.69353
   38    33 S   CT   _C15    38     1.56174   105.86779   -72.96189
   39    38 S   HC   _H3_    39     1.09954   108.51648    49.11962
   40    38 S   CO4  _C16    40     1.52413   109.04376   -65.39445
   41    40 S   O    _O35    41     1.23102   120.11653   141.19082
   42    38 S   CT   _C14    67     1.55214   118.18885   170.48554
   43    42 S   HC   _H14    68     1.09245   110.90076    71.89582
   44    42 S   HC   _H15    69     1.09623   111.39040   -45.40323
   45    40 S   CM   _C17    42     1.49374   119.17103   -42.22436
   46    42 S   CA   _C12    70     1.52551   112.33819  -166.81633
   47    45 S   CM   _C18    43     1.35137   119.84818    13.81161
   48    45 S   CO4  _C23    55     1.50453   120.99551  -166.95645
   49    48 S   O    _O38    56     1.23167   120.19529   142.05100
   50    46 S   CA   _C13    71     1.40553   120.66355   -98.55221
   51    33 S   CT   _C19    44     1.60232   110.05020   165.24498
   52    47 S   OH   _O37    53     1.39231   122.10690  -178.28628
   53    52 S   HO   _H22    54     0.97273   109.44210     8.15981
   54    48 S   CT   _C24    57     1.51936   118.13568   -38.32506
   55    54 S   HC   _H23    58     1.09488   108.12742    85.11313
   56    54 S   HC   _H24    59     1.09580   108.94362   -33.42323
   57    50 S   CA   _C8_    72     1.39896   120.63651   175.67401
   58    50 S   OH   _O34   126     1.37143   117.69845    -4.61308
   59    58 S   HO   _H13   127     0.97046   109.89014  -162.42837
   60    51 S   CT   _C21    45     1.56480   111.69946   -43.69176
   61    60 S   HC   _H16    46     1.09573   111.57267   -49.76227
   62    60 S   HC   _H17    47     1.09746   111.56113  -168.63206
   63    60 S   HC   _H18    48     1.09532   112.45107    72.37501
   64    51 S   CT   _C22    49     1.56096   113.84307  -161.97634
   65    64 S   HC   _H19    50     1.09590   111.81727    61.54531
   66    64 S   HC   _H20    51     1.08928   113.36224   -60.65585
   67    64 S   HC   _H21    52     1.09773   111.26010   179.97202
   68    54 S   CT   _C25    60     1.52705   112.01261  -154.03882
   69    68 S   HC   _H25    61     1.09654   109.86209    56.78865
   70    68 S   HC   _H26    62     1.09651   110.08621   -60.56175
   71    57 S   CA   _C9_    73     1.40218   119.82846     3.14404
   72    57 S   CO4  _C7_   114     1.47953   120.85225  -175.20282
   73    72 S   O    _O33   115     1.22711   118.79202  -122.55755
   74    68 S   CT   _C26    63     1.52020   111.42001   178.21765
   75    74 S   HC   _H27    64     1.09441   110.97429    60.88670
   76    74 S   HC   _H28    65     1.09443   110.26137  -179.44012
   77    74 S   HC   _H29    66     1.09470   111.06197   -59.64128
   78    71 S   CA   _C10    74     1.40786   121.05214    -2.31934
   79    71 S   OH   _O44   112     1.37351   121.18296   178.13838
   80    79 S   HO   _H46   113     0.97267   109.70661    -7.96356
   81    72 S   CT   _C6_   116     1.51640   117.66645    61.61897
   82    81 S   HC   _H11   117     1.09599   107.21510   100.99584
   83    81 S   HC   _H12   118     1.09490   110.42617   -15.54550
   84    46 S   CA   _C11    75     1.40977   120.68387    79.25391
   85    78 S   CT   _C27    78     1.51694   120.09206   179.94065
   86    85 S   HC   _H31    79     1.09585   109.88745    23.78498
   87    85 S   HC   _H32    80     1.09795   108.86848   136.39658
   88    81 S   CT   _C5_   119     1.52482   111.53019  -138.20491
   89    88 S   HC   _H9_   120     1.09605   110.17088    55.39767
   90    88 S   HC   _H10   121     1.09645   109.98170   -61.86568
   91    84 S   OH   _O39    76     1.37314   116.59054     2.63448
   92    91 S   HO   _H30    77     0.96871   110.97176   178.09217
   93    85 S   CT   _C28    81     1.53560   113.00219  -100.02134
   94    93 S   HC   _H4_    82     1.09904   110.36148   -49.06491
   95    88 S   CT   _C4_   122     1.52019   111.35412   176.82356
   96    95 S   HC   _H6_   123     1.09466   110.99083    59.90761
   97    95 S   HC   _H7_   124     1.09488   111.00659   -60.60237
   98    95 S   HC   _H8_   125     1.09443   110.27385   179.67797
   99    93 S   CO4  _C29    83     1.51143   111.86886    68.43338
  100    99 S   O    _O40    84     1.23171   120.59366   -95.80753
  101    99 S   CT   _C30    85     1.51206   117.11412    80.17026
  102   101 S   HC   _H5_    86     1.09671   107.53193   -65.68292
  103   101 S   CO4  _C31    87     1.51803   111.72714    49.82650
  104   103 S   O    _O41    88     1.23364   120.85436   143.92559
  105   101 S   CO4  _C36   100     1.52707   111.28544   177.66762
  106   105 S   O    _O43   101     1.23092   121.59504   -82.91572
  107   103 S   CT   _C32    89     1.53218   117.96267   -43.08693
  108   105 S   CT   _C37   102     1.52128   116.07596    94.46413
  109   108 S   HC   _H39   103     1.09564   107.92457    59.01736
  110   108 S   HC   _H40   104     1.09538   107.92776   -58.23239
  111    93 S   CO4  _C33    90     1.51542   109.92975  -164.82574
  112   111 S   O    _O42    91     1.23559   118.91035    81.23126
  113   107 S   CT   _C34    92     1.53369   107.92646   -88.91007
  114   113 S   HC   _H33    93     1.09593   111.42704   178.68880
  115   113 S   HC   _H34    94     1.09474   111.67901    58.58543
  116   113 S   HC   _H35    95     1.09622   111.22896   -60.80255
  117   107 S   CT   _C35    96     1.54100   108.32848   152.91183
  118   117 S   HC   _H36    97     1.09610   111.77575   177.37058
  119   117 S   HC   _H37    98     1.09609   111.82839    57.24106
  120   117 S   HC   _H38    99     1.09654   110.78812   -62.69397
  121   108 S   CT   _C38   105     1.52549   112.62962  -179.57803
  122   121 S   HC   _H41   106     1.09652   109.95836   -58.79336
  123   121 S   HC   _H42   107     1.09655   109.96319    58.54338
  124   121 S   CT   _C39   108     1.51996   111.43879   179.82306
  125   124 S   HC   _H43   109     1.09476   110.99197   -60.17951
  126   124 S   HC   _H44   110     1.09447   110.27151  -179.93439
  127   124 S   HC   _H45   111     1.09469   110.99670    60.32240
  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
