* LIGAND DATABASE FILE (OPLS2005)
*
001     117   122    237    397     726
    1     0 S   NP   _N1_     1    28.93020    95.66087   -19.63504
    2     1 S   H    _HN1     2     1.02939    93.64190    35.96873
    3     1 S   H    _H1_     3     1.02862    43.73293   147.33036
    4     1 S   H    _H2_     4     1.02799    73.22561   -71.87731
    5     1 S   CT   _CA1     5     1.50156   150.66876  -177.14542
    6     5 S   HC   _HA1     6     1.09607   105.19154    34.83203
    7     5 S   CO3  _C1_     7     1.54008   111.46866   -84.57811
    8     7 S   O2Z  _O11     8     1.26272   115.44583   -67.50836
    9     7 S   O2Z  _O12     9     1.26331   114.75821   111.05746
   10     5 S   CT   _CB1    10     1.53136   107.25727   151.94364
   11    10 S   HC   HB11    11     1.09827   109.61098   -50.49161
   12    10 S   HC   HB12    12     1.09808   110.43521    66.03665
   13    10 S   CT   _CG1    13     1.53033   112.48308  -171.45266
   14    13 S   HC   HG11    14     1.09512   110.28726   -55.23252
   15    13 S   HC   HG12    15     1.09612   110.19412    63.67051
   16    13 S   C    _CD1    16     1.51929   111.83446  -176.20424
   17    16 S   O    _OE1    17     1.22760   123.00143   -15.72211
   18    16 S   N    _N2_    18     1.38567   111.96313   164.92127
   19    18 S   H    _HN2    19     1.01591   119.01937     1.99782
   20    18 S   CT1  _CA2    20     1.46315   123.48939  -176.25937
   21    20 S   HC   _HA2    21     1.09724   109.37652   -14.55966
   22    20 S   C    _C2_    22     1.53412   108.00524  -130.27961
   23    22 S   O    _O2_    23     1.23000   122.37186  -144.70195
   24    20 S   CT   _CB2    32     1.53782   111.55585   107.61171
   25    24 S   HC   HB21    33     1.09320   109.27224    55.77351
   26    24 S   HC   HB22    34     1.09474   109.89205   174.22016
   27    22 S   N    _N3_    24     1.38550   113.29448    42.54089
   28    27 S   H    _HN3    25     1.01528   118.89624    -0.45111
   29    24 S   S    _SG2    35     1.83191   111.61667   -66.24620
   30    27 S   CT   _CA3    26     1.45436   123.38360   175.25422
   31    30 S   HC   HA31    27     1.09528   109.15618    25.95906
   32    30 S   HC   HA32    28     1.09494   107.14170   142.94384
   33    29 S   CT   _C27    36     1.86435   102.22956   166.59910
   34    30 S   CO3  _C3_    29     1.52927   113.16966   -97.46535
   35    34 S   O2Z  _O31    30     1.26399   115.42741   -44.15617
   36    34 S   O2Z  _O32    31     1.26359   114.96943   136.79162
   37    33 S   CM   _C30    37     1.49889   107.52432    58.83542
   38    37 S   HC   _H36    38     1.08372   122.93248   -81.98150
   39    33 S   CT   _C26    45     1.56443   113.99535   -66.78621
   40    39 S   HC   _H12    46     1.09743   105.17603    63.50848
   41    37 S   CMA  _C29    39     1.34352   113.32212    97.94980
   42    41 S   OM   _O36    40     1.26139   127.22786  -179.41483
   43    39 S   CT   _C25    47     1.54165   113.97827   176.27348
   44    43 S   HC   _H32    48     1.09385   112.50624    57.63088
   45    43 S   HC   _H33    49     1.09445   112.54375   -64.94976
   46    41 S   OS   _O35    41     1.41848   109.31959    -1.13539
   47    43 S   CT   _C24    50     1.52017   102.94805   175.75536
   48    47 S   HC   _H30    51     1.09396   108.96363    74.78732
   49    47 S   HC   _H31    52     1.09525   110.52067  -166.43678
   50    33 S   CT   _C28    42     1.53447   107.95809   163.16606
   51    50 S   HC   _H34    43     1.09551   114.02193    32.12779
   52    50 S   HC   _H35    44     1.09432   113.39584   154.61714
   53    47 S   CT   _C23    53     1.53471   103.52323   -45.31325
   54    53 S   CT   _C18    54     1.55302   114.12633   156.71497
   55    54 S   HC   _H10    55     1.09773   105.59508   176.97198
   56    53 S   OH   _O37   116     1.43764   105.04639   -84.99063
   57    56 S   HO   _H37   117     0.97214   108.22337  -170.97437
   58    54 S   CT   _C17    56     1.54027   112.97009    62.24548
   59    58 S   HC   _H24    57     1.09599   110.50644    56.90407
   60    58 S   HC   _H25    58     1.09689   109.97062   -60.64719
   61    54 S   CT   _C19    76     1.55623   112.84003   -64.21204
   62    61 S   HC   _H11    77     1.10039   106.63069    70.63903
   63    58 S   CT   _C16    59     1.52887   112.07524   178.01791
   64    63 S   HC   _H22    60     1.09695   108.57604   175.75693
   65    63 S   HC   _H23    61     1.09592   110.02592   -68.19020
   66    61 S   CT   _C20    78     1.54138   111.93456   -43.29280
   67    66 S   HC   _H26    79     1.09192   112.54170  -135.35277
   68    66 S   HC   _H27    80     1.09631   108.35943   110.16520
   69    63 S   CT   _C14    62     1.53238   111.08677    54.89642
   70    69 S   HC   _H9_    63     1.10169   106.05013    59.10509
   71    66 S   CT   _C21    81     1.52570   113.44590   -11.64721
   72    71 S   HC   _H28    82     1.08935   108.86018  -178.01111
   73    71 S   HC   _H29    83     1.09841   107.83105   -64.64794
   74    69 S   CT   _C15    64     1.53491   111.55783   173.73321
   75    74 S   HC   _H20    65     1.09677   109.25593   -54.02321
   76    74 S   HC   _H21    66     1.09622   111.60744    61.52686
   77    39 S   CT   _C22    84     1.58684   122.31645   -58.17412
   78    74 S   CT   _C10    67     1.53313   111.26068  -174.72764
   79    78 S   HC   _H8_    68     1.09781   109.63090    66.81565
   80    77 S   CT   _C31    85     1.54241   113.11942   -29.68525
   81    80 S   HC   _H38    86     1.09380   112.08894   -55.18081
   82    80 S   HC   _H39    87     1.09671   110.88223  -174.97570
   83    80 S   HC   _H40    88     1.09330   111.97758    66.68344
   84    78 S   CT   _C11    69     1.52983   111.52200   -52.84059
   85    84 S   HC   _H16    70     1.09690   110.07753   -71.56362
   86    84 S   HC   _H17    71     1.09758   109.00947   173.90996
   87    78 S   OS   _O34    94     1.43058   110.45549  -171.81079
   88    84 S   CT   _C12    72     1.52970   112.67050    52.29006
   89    88 S   HC   _H18    73     1.09822   108.39843    66.13551
   90    88 S   HC   _H19    74     1.09490   108.13433  -179.33236
   91    87 S   CO   _C9_    95     1.42975   114.13575   -83.24305
   92    91 S   HC   _H7_    96     1.09517   109.68701    50.36985
   93    69 S   CT   _C13    75     1.56706   112.63594   -57.93827
   94    91 S   CT   _C8_    97     1.53405   108.77283   168.84225
   95    94 S   HC   _H6_    98     1.09615   111.03389   -52.22998
   96    93 S   CT   _C32    89     1.56043   111.43027   -64.55993
   97    96 S   HC   _H41    90     1.09222   112.17984    66.28091
   98    96 S   HC   _H42    91     1.09279   111.78017   -53.29564
   99    94 S   CT   _C7_    99     1.53179   110.63364    69.24672
  100    99 S   HC   _H5_   100     1.09696   110.08109   -68.64142
  101    94 S   OH   _O39   114     1.42978   109.30092  -170.46640
  102   101 S   HO   _H44   115     0.97238   107.74760    60.40693
  103    96 S   OH   _O38    92     1.42081   111.61444  -172.65022
  104   103 S   HO   _H43    93     0.97583   107.51111  -172.26944
  105    99 S   CT   _C6_   101     1.53126   110.80685    52.62943
  106   105 S   HC   _H4_   102     1.09669   109.33549    70.16943
  107    99 S   OH   _O40   112     1.42724   110.43697   173.93518
  108   107 S   HO   _H45   113     0.97210   107.67691    52.83489
  109   105 S   CT   _C5_   103     1.53472   110.30522   -51.55653
  110   109 S   HC   _H3_   104     1.09764   110.20008   -67.15223
  111   105 S   OH   _O41   110     1.42769   109.83614  -172.84821
  112   111 S   HO   _H46   111     0.97227   108.07639    57.51053
  113    91 S   OS   _O33   105     1.43444   113.17290   -68.33687
  114   109 S   CT   _C4_   106     1.52567   111.49361   173.85927
  115   114 S   HC   _H13   107     1.09562   110.89886   -60.95016
  116   114 S   HC   _H14   108     1.09559   110.27884  -178.81783
  117   114 S   HC   _H15   109     1.09397   111.70916    60.52811
  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  12   5   4   3
  18   2   1   1  11   5  24   9   5   2  12   6   5   3  12   5
   4   3   1   1  20  21  10   6   1  13   6   5  21   8  11   5
   4  11   6   5  16   7   8   3   2  12   6   5   4  13   6   3
   2   1   1   9   6   5   9   7   3   2  13   6   5  12   7   4
   3   2  13   7   4   1   1   1  12   7   3   1   8   6   3   1
   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    50    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    46    50    51    52    39    40    43    77  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    46    50    51    52    39    40    43    44    45    47    53    71    77    80  
   35    36  
   36  
    0  
   38    41    42    46    50    51    52    39    40    43    77  
   41    42    46    50    39  
   40    43    44    45    47    48    49    53    54    66    71    72    73    77    80    81    82    83    56    41    46    50    51    52  
   43    44    45    47    53    71    77    80    50  
   42    46    50    51    52  
   46    50  
   44    45    47    48    49    53    54    71    77    80    56    50  
   45    47    48    49    53    77  
   47    48    49    53    77  
   50    51    52  
   48    49    53    54    55    58    61    71    77    80    56    57  
   49    53    54    77    56  
   53    54    77    56  
   51    52    77  
   52  
    0  
   54    55    58    59    60    63    93    61    62    66    71    72    73    77    80    81    82    83    56    57  
   55    58    59    60    63    64    65    69    88    93    61    62    66    67    68    71    77    80    96    56    57  
   58    59    60    63    93    61    62    66    77    56  
   57    58    61    71    77    80  
   77  
   59    60    63    64    65    69    70    74    93    61    62    66    77  
   60    63    64    65    69    61  
   63    64    65    69    61  
   62    66    67    68    71    72    73    77    96    97    98   103    63    69    70    74    84    88    89    90    93  
   66    67    68    71    96    69    88    93  
   64    65    69    70    74    75    76    78    88    93    96  
   65    69    70    74    93  
   69    70    74    93  
   67    68    71    72    73    77    80    96    69    88    93  
   68    71    72    73    77    93  
   71    72    73    77    93  
   70    74    75    76    78    79    84    88    89    90    93    96    97    98   103    87  
   74    75    76    78    88    93    96  
   72    73    77    80    81    82    83    93  
   73    77    80  
   77    80  
   75    76    78    79    84    85    86    88    93    96    87    91  
   76    78    79    84    93    87  
   78    79    84    93    87  
   80    81    82    83  
   79    84    85    86    88    89    90    93    87    91    92    94   113  
   84    85    86    88    87    91  
   81    82    83  
   82    83  
   83  
    0  
   85    86    88    89    90    93    96    87    91  
   86    88    89    90    93    87  
   88    89    90    93    87  
   91    92    94    95    99   109   113   101    88  
   89    90    93    96    97    98   103  
   90    93    96  
   93    96  
   92    94    95    99   100   105   109   110   113   114   107   101   102  
   94    95    99   109   113   101  
   96    97    98   103   104  
   95    99   100   105   106   109   113   111   107   108   101   102  
   99   100   105   113   107   101   102  
   97    98   103   104  
   98   103   104  
  103   104  
  100   105   106   109   110   113   114   111   112   107   108   101   102  
  105   106   109   111   107   108   101  
  102   105   107   113  
    0  
  104  
    0  
  106   109   110   113   114   115   116   117   111   112   107   108  
  109   110   113   114   111   112   107  
  108   109   111  
    0  
  110   113   114   115   116   117   111   112  
  113   114   115   116   117   111  
  112   113   114  
    0  
  114   115   116   117  
  115   116   117  
  116   117  
  117  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   47   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   54   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   57   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   58   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   3.5000   0.0660  -0.120000   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   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   78   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   80   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   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   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   93   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   94   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
  100   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  101   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  102   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  103   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  104   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  105   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  108   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  109   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
  110   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
  111   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  112   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  113   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
  114   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    50   268.000  1.529
   33    39   268.000  1.529
   37    38   340.000  1.080
   37    41   465.000  1.376
   41    42   745.000  1.250
   41    46   440.000  1.360
   46    50   320.000  1.410
   50    51   340.000  1.090
   50    52   340.000  1.090
   39    40   340.000  1.090
   39    43   268.000  1.529
   39    77   268.000  1.529
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    47   268.000  1.529
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    53   268.000  1.529
   53    54   268.000  1.529
   53    77   268.000  1.529
   53    56   320.000  1.410
   54    55   340.000  1.090
   54    58   268.000  1.529
   54    61   268.000  1.529
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    63   268.000  1.529
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    69   268.000  1.529
   69    70   340.000  1.090
   69    74   268.000  1.529
   69    93   268.000  1.529
   74    75   340.000  1.090
   74    76   340.000  1.090
   74    78   268.000  1.529
   78    79   340.000  1.090
   78    84   268.000  1.529
   78    87   320.000  1.410
   84    85   340.000  1.090
   84    86   340.000  1.090
   84    88   268.000  1.529
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    93   268.000  1.529
   93    61   268.000  1.529
   93    96   268.000  1.529
   61    62   340.000  1.090
   61    66   268.000  1.529
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    71   268.000  1.529
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    77   268.000  1.529
   77    80   268.000  1.529
   80    81   340.000  1.090
   80    82   340.000  1.090
   80    83   340.000  1.090
   96    97   340.000  1.090
   96    98   340.000  1.090
   96   103   320.000  1.410
  103   104   553.000  0.945
   87    91   320.000  1.380
   91    92   340.000  1.090
   91    94   250.000  1.527
   91   113   320.000  1.380
   94    95   340.000  1.090
   94    99   268.000  1.529
   94   101   320.000  1.410
   99   100   340.000  1.090
   99   105   268.000  1.529
   99   107   320.000  1.410
  105   106   340.000  1.090
  105   109   268.000  1.529
  105   111   320.000  1.410
  109   110   340.000  1.090
  109   113   320.000  1.410
  109   114   268.000  1.529
  114   115   340.000  1.090
  114   116   340.000  1.090
  114   117   340.000  1.090
  111   112   553.000  0.945
  107   108   553.000  0.945
  101   102   553.000  0.945
   56    57   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    50    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    35.00000  117.00000
   33    37    41    70.00000  124.00000
   33    50    46    50.00000  109.50000
   33    50    51    37.50000  110.70000
   33    50    52    37.50000  110.70000
   33    39    40    37.50000  110.70000
   33    39    43    58.35000  112.70000
   33    39    77    58.35000  112.70000
   37    41    42    65.00000  137.10300
   37    41    46    80.00000  120.01400
   41    37    38    40.00000  120.50800
   41    46    50    90.00000  111.18400
   46    41    42    65.00000  121.00000
   46    50    51    35.00000  109.50000
   46    50    52    35.00000  109.50000
   50    33    37    70.00000  112.02700
   52    50    51    33.00000  107.80000
   39    33    37    70.00000  112.02700
   39    33    50    58.35000  112.70000
   39    43    44    37.50000  110.70000
   39    43    45    37.50000  110.70000
   39    43    47    58.35000  112.70000
   39    77    53    58.35000  112.70000
   39    77    71    58.35000  112.70000
   39    77    80    58.35000  112.70000
   43    39    40    37.50000  110.70000
   43    47    48    37.50000  110.70000
   43    47    49    37.50000  110.70000
   43    47    53    58.35000  112.70000
   45    43    44    33.00000  107.80000
   47    43    44    37.50000  110.70000
   47    43    45    37.50000  110.70000
   47    53    54    58.35000  112.70000
   47    53    77    58.35000  112.70000
   47    53    56    50.00000  109.50000
   49    47    48    33.00000  107.80000
   53    47    48    37.50000  110.70000
   53    47    49    37.50000  110.70000
   53    54    55    37.50000  110.70000
   53    54    58    58.35000  112.70000
   53    54    61    58.35000  112.70000
   53    77    71    58.35000  112.70000
   53    77    80    58.35000  112.70000
   53    56    57    55.00000  108.50000
   54    58    59    37.50000  110.70000
   54    58    60    37.50000  110.70000
   54    58    63    58.35000  112.70000
   54    61    93    58.35000  112.70000
   54    61    62    37.50000  110.70000
   54    61    66    58.35000  112.70000
   58    54    55    37.50000  110.70000
   58    63    64    37.50000  110.70000
   58    63    65    37.50000  110.70000
   58    63    69    58.35000  112.70000
   60    58    59    33.00000  107.80000
   63    58    59    37.50000  110.70000
   63    58    60    37.50000  110.70000
   63    69    70    37.50000  110.70000
   63    69    74    58.35000  112.70000
   63    69    93    58.35000  112.70000
   65    63    64    33.00000  107.80000
   69    63    64    37.50000  110.70000
   69    63    65    37.50000  110.70000
   69    74    75    37.50000  110.70000
   69    74    76    37.50000  110.70000
   69    74    78    58.35000  112.70000
   69    93    88    58.35000  112.70000
   69    93    61    58.35000  112.70000
   69    93    96    58.35000  112.70000
   74    69    70    37.50000  110.70000
   74    78    79    37.50000  110.70000
   74    78    84    58.35000  112.70000
   74    78    87    50.00000  109.50000
   76    74    75    33.00000  107.80000
   78    74    75    37.50000  110.70000
   78    74    76    37.50000  110.70000
   78    84    85    37.50000  110.70000
   78    84    86    37.50000  110.70000
   78    84    88    58.35000  112.70000
   78    87    91    60.00000  109.50000
   84    78    79    37.50000  110.70000
   84    88    89    37.50000  110.70000
   84    88    90    37.50000  110.70000
   84    88    93    58.35000  112.70000
   86    84    85    33.00000  107.80000
   88    84    85    37.50000  110.70000
   88    84    86    37.50000  110.70000
   88    93    61    58.35000  112.70000
   88    93    96    58.35000  112.70000
   90    88    89    33.00000  107.80000
   93    69    70    37.50000  110.70000
   93    69    74    58.35000  112.70000
   93    88    89    37.50000  110.70000
   93    88    90    37.50000  110.70000
   93    61    62    37.50000  110.70000
   93    61    66    58.35000  112.70000
   93    96    97    37.50000  110.70000
   93    96    98    37.50000  110.70000
   93    96   103    50.00000  109.50000
   61    54    55    37.50000  110.70000
   61    54    58    58.35000  112.70000
   61    66    67    37.50000  110.70000
   61    66    68    37.50000  110.70000
   61    66    71    58.35000  112.70000
   66    61    62    37.50000  110.70000
   66    71    72    37.50000  110.70000
   66    71    73    37.50000  110.70000
   66    71    77    58.35000  112.70000
   68    66    67    33.00000  107.80000
   71    66    67    37.50000  110.70000
   71    66    68    37.50000  110.70000
   71    77    80    58.35000  112.70000
   73    71    72    33.00000  107.80000
   77    39    40    37.50000  110.70000
   77    39    43    58.35000  112.70000
   77    53    54    58.35000  112.70000
   77    71    72    37.50000  110.70000
   77    71    73    37.50000  110.70000
   77    80    81    37.50000  110.70000
   77    80    82    37.50000  110.70000
   77    80    83    37.50000  110.70000
   82    80    81    33.00000  107.80000
   83    80    81    33.00000  107.80000
   83    80    82    33.00000  107.80000
   96    93    61    58.35000  112.70000
   96   103   104    55.00000  108.50000
   98    96    97    33.00000  107.80000
  103    96    97    35.00000  109.50000
  103    96    98    35.00000  109.50000
   87    78    79    35.00000  109.50000
   87    78    84    50.00000  109.50000
   87    91    92    35.00000  109.50000
   87    91    94    90.00000  108.56700
   87    91   113    92.60000  111.55000
   91    94    95    45.00000  108.72000
   91    94    99    75.00000  109.43000
   91    94   101    90.00000  111.58700
   91   113   109    60.00000  109.50000
   94    91    92    45.00000  112.01100
   94    99   100    37.50000  110.70000
   94    99   105    58.35000  112.70000
   94    99   107    50.00000  109.50000
   94   101   102    55.00000  108.50000
   99    94    95    37.50000  110.70000
   99   105   106    37.50000  110.70000
   99   105   109    58.35000  112.70000
   99   105   111    50.00000  109.50000
   99   107   108    55.00000  108.50000
  105    99   100    37.50000  110.70000
  105   109   110    37.50000  110.70000
  105   109   113    50.00000  109.50000
  105   109   114    58.35000  112.70000
  105   111   112    55.00000  108.50000
  109   105   106    37.50000  110.70000
  109   114   115    37.50000  110.70000
  109   114   116    37.50000  110.70000
  109   114   117    37.50000  110.70000
  113    91    92    35.00000  109.50000
  113    91    94    90.00000  108.56700
  113   109   110    35.00000  109.50000
  114   109   110    37.50000  110.70000
  114   109   113    50.00000  109.50000
  116   114   115    33.00000  107.80000
  117   114   115    33.00000  107.80000
  117   114   116    33.00000  107.80000
  111   105   106    35.00000  109.50000
  111   105   109    50.00000  109.50000
  107    99   100    35.00000  109.50000
  107    99   105    50.00000  109.50000
  101    94    95    35.00000  109.50000
  101    94    99    50.00000  109.50000
   56    53    54    50.00000  109.50000
   56    53    77    50.00000  109.50000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    50   0.01700  1.0 1.0
   24    29    33    50  -0.23550 -1.0 2.0
   24    29    33    50   0.21350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.00000  1.0 1.0
   29    33    37    41   0.42700  1.0 1.0
   29    33    37    41  -0.70350 -1.0 2.0
   29    33    37    41  -0.43150  1.0 3.0
   29    33    50    46   0.56750  1.0 1.0
   29    33    50    46  -0.07550 -1.0 2.0
   29    33    50    46   0.20000  1.0 3.0
   29    33    50    51   0.15000  1.0 3.0
   29    33    50    52   0.15000  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    43   0.44750  1.0 1.0
   29    33    39    43  -0.17800 -1.0 2.0
   29    33    39    43   0.20200  1.0 3.0
   29    33    39    77   0.44750  1.0 1.0
   29    33    39    77  -0.17800 -1.0 2.0
   29    33    39    77   0.20200  1.0 3.0
   33    37    41    42   7.00000 -1.0 2.0
   33    37   -41    46   7.00000 -1.0 2.0
   33    39    43    44   0.15000  1.0 3.0
   33    39    43    45   0.15000  1.0 3.0
   33    39    43    47   0.56750  1.0 1.0
   33    39    43    47  -0.07550 -1.0 2.0
   33    39    43    47   0.20000  1.0 3.0
   33    39    77    53   0.56750  1.0 1.0
   33    39    77    53  -0.07550 -1.0 2.0
   33    39    77    53   0.20000  1.0 3.0
   33    39    77    71   0.56750  1.0 1.0
   33    39    77    71  -0.07550 -1.0 2.0
   33    39    77    71   0.20000  1.0 3.0
   33    39    77    80   0.56750  1.0 1.0
   33    39    77    80  -0.07550 -1.0 2.0
   33    39    77    80   0.20000  1.0 3.0
   37    33   -50    46   0.61850  1.0 1.0
   37    33   -50    46  -0.22750 -1.0 2.0
   37    33   -50    46   0.15300  1.0 3.0
   37    33    50    51   0.15000  1.0 3.0
   37    33    50    52   0.15000  1.0 3.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    43   0.34400  1.0 1.0
   37    33    39    43   0.09450 -1.0 2.0
   37    33    39    43   0.11100  1.0 3.0
   37    33    39    77   0.34400  1.0 1.0
   37    33    39    77   0.09450 -1.0 2.0
   37    33    39    77   0.11100  1.0 3.0
   37    41   -46    50  -2.26850  1.0 1.0
   37    41   -46    50   3.39050 -1.0 2.0
   38    37    41    42   7.00000 -1.0 2.0
   38    37    41    46   7.00000 -1.0 2.0
   41    46   -50    33  -0.46850  1.0 1.0
   41    46   -50    33   0.09300 -1.0 2.0
   41    46   -50    33  -0.12850  1.0 3.0
   41    46    50    51   0.08050  1.0 3.0
   41    46    50    52   0.08050  1.0 3.0
   42    41    46    50   2.00000 -1.0 2.0
   50    33    37    38   0.00000  1.0 1.0
   50    33   -37    41   0.09850  1.0 1.0
   50    33   -37    41   0.15250 -1.0 2.0
   50    33   -37    41  -0.50650  1.0 3.0
   50    33    39    40   0.15000  1.0 3.0
   50    33    39    43   0.56750  1.0 1.0
   50    33    39    43  -0.07550 -1.0 2.0
   50    33    39    43   0.20000  1.0 3.0
   50    33    39    77   0.56750  1.0 1.0
   50    33    39    77  -0.07550 -1.0 2.0
   50    33    39    77   0.20000  1.0 3.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    41   0.09850  1.0 1.0
   39    33    37    41   0.15250 -1.0 2.0
   39    33    37    41  -0.50650  1.0 3.0
   39    33    50    46   0.62750  1.0 1.0
   39    33    50    46  -0.30950 -1.0 2.0
   39    33    50    46   0.27300  1.0 3.0
   39    33    50    51   0.15000  1.0 3.0
   39    33    50    52   0.15000  1.0 3.0
   39    43    47    48   0.15000  1.0 3.0
   39    43    47    49   0.15000  1.0 3.0
   39    43   -47    53   0.56750  1.0 1.0
   39    43   -47    53  -0.07550 -1.0 2.0
   39    43   -47    53   0.20000  1.0 3.0
   39    77    80    81   0.15000  1.0 3.0
   39    77    80    82   0.15000  1.0 3.0
   39    77    80    83   0.15000  1.0 3.0
   40    39    43    44   0.15000  1.0 3.0
   40    39    43    45   0.15000  1.0 3.0
   40    39    43    47   0.15000  1.0 3.0
   40    39    77    53   0.15000  1.0 3.0
   40    39    77    71   0.15000  1.0 3.0
   40    39    77    80   0.15000  1.0 3.0
   43    39   -77    53   0.56750  1.0 1.0
   43    39   -77    53  -0.07550 -1.0 2.0
   43    39   -77    53   0.20000  1.0 3.0
   43    39    77    71   0.56750  1.0 1.0
   43    39    77    71  -0.07550 -1.0 2.0
   43    39    77    71   0.20000  1.0 3.0
   43    39    77    80   0.56750  1.0 1.0
   43    39    77    80  -0.07550 -1.0 2.0
   43    39    77    80   0.20000  1.0 3.0
   43    47    53    54   0.56750  1.0 1.0
   43    47    53    54  -0.07550 -1.0 2.0
   43    47    53    54   0.20000  1.0 3.0
   43    47   -53    77   0.56750  1.0 1.0
   43    47   -53    77  -0.07550 -1.0 2.0
   43    47   -53    77   0.20000  1.0 3.0
   43    47    53    56   0.86500  1.0 1.0
   43    47    53    56  -0.17500 -1.0 2.0
   43    47    53    56   0.20800  1.0 3.0
   44    43    47    48   0.15000  1.0 3.0
   44    43    47    49   0.15000  1.0 3.0
   44    43    47    53   0.15000  1.0 3.0
   45    43    47    48   0.15000  1.0 3.0
   45    43    47    49   0.15000  1.0 3.0
   45    43    47    53   0.15000  1.0 3.0
   47    53    54    55   0.15000  1.0 3.0
   47    53    54    58   0.56750  1.0 1.0
   47    53    54    58  -0.07550 -1.0 2.0
   47    53    54    58   0.20000  1.0 3.0
   47    53    54    61   0.56750  1.0 1.0
   47    53    54    61  -0.07550 -1.0 2.0
   47    53    54    61   0.20000  1.0 3.0
   47    53   -77    39   0.56750  1.0 1.0
   47    53   -77    39  -0.07550 -1.0 2.0
   47    53   -77    39   0.20000  1.0 3.0
   47    53    77    71   0.56750  1.0 1.0
   47    53    77    71  -0.07550 -1.0 2.0
   47    53    77    71   0.20000  1.0 3.0
   47    53    77    80   0.56750  1.0 1.0
   47    53    77    80  -0.07550 -1.0 2.0
   47    53    77    80   0.20000  1.0 3.0
   47    53    56    57  -0.11600  1.0 1.0
   47    53    56    57  -0.09450 -1.0 2.0
   47    53    56    57   0.21250  1.0 3.0
   48    47    53    54   0.15000  1.0 3.0
   48    47    53    77   0.15000  1.0 3.0
   48    47    53    56   0.23400  1.0 3.0
   49    47    53    54   0.15000  1.0 3.0
   49    47    53    77   0.15000  1.0 3.0
   49    47    53    56   0.23400  1.0 3.0
   53    54    58    59   0.15000  1.0 3.0
   53    54    58    60   0.15000  1.0 3.0
   53    54    58    63   0.56750  1.0 1.0
   53    54    58    63  -0.07550 -1.0 2.0
   53    54    58    63   0.20000  1.0 3.0
   53    54    61    93   0.56750  1.0 1.0
   53    54    61    93  -0.07550 -1.0 2.0
   53    54    61    93   0.20000  1.0 3.0
   53    54    61    62   0.15000  1.0 3.0
   53    54    61    66   0.56750  1.0 1.0
   53    54    61    66  -0.07550 -1.0 2.0
   53    54    61    66   0.20000  1.0 3.0
   53    77    80    81   0.15000  1.0 3.0
   53    77    80    82   0.15000  1.0 3.0
   53    77    80    83   0.15000  1.0 3.0
   54    53    77    39   0.56750  1.0 1.0
   54    53    77    39  -0.07550 -1.0 2.0
   54    53    77    39   0.20000  1.0 3.0
   54    53    77    71   0.56750  1.0 1.0
   54    53    77    71  -0.07550 -1.0 2.0
   54    53    77    71   0.20000  1.0 3.0
   54    53    77    80   0.56750  1.0 1.0
   54    53    77    80  -0.07550 -1.0 2.0
   54    53    77    80   0.20000  1.0 3.0
   54    53    56    57  -0.11600  1.0 1.0
   54    53    56    57  -0.09450 -1.0 2.0
   54    53    56    57   0.21250  1.0 3.0
   54    58    63    64   0.15000  1.0 3.0
   54    58    63    65   0.15000  1.0 3.0
   54    58    63    69   0.56750  1.0 1.0
   54    58    63    69  -0.07550 -1.0 2.0
   54    58    63    69   0.20000  1.0 3.0
   54    61    66    67   0.15000  1.0 3.0
   54    61    66    68   0.15000  1.0 3.0
   54    61   -66    71   0.56750  1.0 1.0
   54    61   -66    71  -0.07550 -1.0 2.0
   54    61   -66    71   0.20000  1.0 3.0
   55    54    58    59   0.15000  1.0 3.0
   55    54    58    60   0.15000  1.0 3.0
   55    54    58    63   0.15000  1.0 3.0
   55    54    61    93   0.15000  1.0 3.0
   55    54    61    62   0.15000  1.0 3.0
   55    54    61    66   0.15000  1.0 3.0
   58    54    61    93   0.56750  1.0 1.0
   58    54    61    93  -0.07550 -1.0 2.0
   58    54    61    93   0.20000  1.0 3.0
   58    54    61    62   0.15000  1.0 3.0
   58    54    61    66   0.56750  1.0 1.0
   58    54    61    66  -0.07550 -1.0 2.0
   58    54    61    66   0.20000  1.0 3.0
   58    63    69    70   0.15000  1.0 3.0
   58    63    69    74   0.56750  1.0 1.0
   58    63    69    74  -0.07550 -1.0 2.0
   58    63    69    74   0.20000  1.0 3.0
   58    63   -69    93   0.56750  1.0 1.0
   58    63   -69    93  -0.07550 -1.0 2.0
   58    63   -69    93   0.20000  1.0 3.0
   59    58    63    64   0.15000  1.0 3.0
   59    58    63    65   0.15000  1.0 3.0
   59    58    63    69   0.15000  1.0 3.0
   60    58    63    64   0.15000  1.0 3.0
   60    58    63    65   0.15000  1.0 3.0
   60    58    63    69   0.15000  1.0 3.0
   63    69    74    75   0.15000  1.0 3.0
   63    69    74    76   0.15000  1.0 3.0
   63    69    74    78   0.56750  1.0 1.0
   63    69    74    78  -0.07550 -1.0 2.0
   63    69    74    78   0.20000  1.0 3.0
   63    69    93    88   0.56750  1.0 1.0
   63    69    93    88  -0.07550 -1.0 2.0
   63    69    93    88   0.20000  1.0 3.0
   63    69    93    61   0.56750  1.0 1.0
   63    69    93    61  -0.07550 -1.0 2.0
   63    69    93    61   0.20000  1.0 3.0
   63    69    93    96   0.56750  1.0 1.0
   63    69    93    96  -0.07550 -1.0 2.0
   63    69    93    96   0.20000  1.0 3.0
   64    63    69    70   0.15000  1.0 3.0
   64    63    69    74   0.15000  1.0 3.0
   64    63    69    93   0.15000  1.0 3.0
   65    63    69    70   0.15000  1.0 3.0
   65    63    69    74   0.15000  1.0 3.0
   65    63    69    93   0.15000  1.0 3.0
   69    74    78    79   0.15000  1.0 3.0
   69    74    78    84   0.56750  1.0 1.0
   69    74    78    84  -0.07550 -1.0 2.0
   69    74    78    84   0.20000  1.0 3.0
   69    74    78    87   0.62750  1.0 1.0
   69    74    78    87  -0.30950 -1.0 2.0
   69    74    78    87   0.27300  1.0 3.0
   69    93   -61    54   0.56750  1.0 1.0
   69    93   -61    54  -0.07550 -1.0 2.0
   69    93   -61    54   0.20000  1.0 3.0
   69    93    61    62   0.15000  1.0 3.0
   69    93    61    66   0.56750  1.0 1.0
   69    93    61    66  -0.07550 -1.0 2.0
   69    93    61    66   0.20000  1.0 3.0
   69    93    96    97   0.15000  1.0 3.0
   69    93    96    98   0.15000  1.0 3.0
   69    93    96   103   0.86500  1.0 1.0
   69    93    96   103  -0.17500 -1.0 2.0
   69    93    96   103   0.20800  1.0 3.0
   70    69    74    75   0.15000  1.0 3.0
   70    69    74    76   0.15000  1.0 3.0
   70    69    74    78   0.15000  1.0 3.0
   70    69    93    88   0.15000  1.0 3.0
   70    69    93    61   0.15000  1.0 3.0
   70    69    93    96   0.15000  1.0 3.0
   74    69    93    88   0.56750  1.0 1.0
   74    69    93    88  -0.07550 -1.0 2.0
   74    69    93    88   0.20000  1.0 3.0
   74    69    93    61   0.56750  1.0 1.0
   74    69    93    61  -0.07550 -1.0 2.0
   74    69    93    61   0.20000  1.0 3.0
   74    69    93    96   0.56750  1.0 1.0
   74    69    93    96  -0.07550 -1.0 2.0
   74    69    93    96   0.20000  1.0 3.0
   74    78    84    85   0.15000  1.0 3.0
   74    78    84    86   0.15000  1.0 3.0
   74    78   -84    88   0.56750  1.0 1.0
   74    78   -84    88  -0.07550 -1.0 2.0
   74    78   -84    88   0.20000  1.0 3.0
   74    78    87    91   0.06250  1.0 1.0
   74    78    87    91  -0.01100 -1.0 2.0
   74    78    87    91   0.28050  1.0 3.0
   75    74    78    79   0.15000  1.0 3.0
   75    74    78    84   0.15000  1.0 3.0
   75    74    78    87   0.23400  1.0 3.0
   76    74    78    79   0.15000  1.0 3.0
   76    74    78    84   0.15000  1.0 3.0
   76    74    78    87   0.23400  1.0 3.0
   78    84    88    89   0.15000  1.0 3.0
   78    84    88    90   0.15000  1.0 3.0
   78    84    88    93   0.56750  1.0 1.0
   78    84    88    93  -0.07550 -1.0 2.0
   78    84    88    93   0.20000  1.0 3.0
   78    87    91    92   0.37050  1.0 3.0
   78    87    91    94   0.06250  1.0 1.0
   78    87    91    94  -0.01100 -1.0 2.0
   78    87    91    94   0.28050  1.0 3.0
   78    87    91   113  -0.53350  1.0 1.0
   78    87    91   113  -0.78350 -1.0 2.0
   78    87    91   113   0.33750  1.0 3.0
   79    78    84    85   0.15000  1.0 3.0
   79    78    84    86   0.15000  1.0 3.0
   79    78    84    88   0.15000  1.0 3.0
   79    78    87    91   0.37050  1.0 3.0
   84    78    87    91   0.06250  1.0 1.0
   84    78    87    91  -0.01100 -1.0 2.0
   84    78    87    91   0.28050  1.0 3.0
   84    88   -93    69   0.56750  1.0 1.0
   84    88   -93    69  -0.07550 -1.0 2.0
   84    88   -93    69   0.20000  1.0 3.0
   84    88    93    61   0.56750  1.0 1.0
   84    88    93    61  -0.07550 -1.0 2.0
   84    88    93    61   0.20000  1.0 3.0
   84    88    93    96   0.56750  1.0 1.0
   84    88    93    96  -0.07550 -1.0 2.0
   84    88    93    96   0.20000  1.0 3.0
   85    84    88    89   0.15000  1.0 3.0
   85    84    88    90   0.15000  1.0 3.0
   85    84    88    93   0.15000  1.0 3.0
   86    84    88    89   0.15000  1.0 3.0
   86    84    88    90   0.15000  1.0 3.0
   86    84    88    93   0.15000  1.0 3.0
   88    93    61    54   0.56750  1.0 1.0
   88    93    61    54  -0.07550 -1.0 2.0
   88    93    61    54   0.20000  1.0 3.0
   88    93    61    62   0.15000  1.0 3.0
   88    93    61    66   0.56750  1.0 1.0
   88    93    61    66  -0.07550 -1.0 2.0
   88    93    61    66   0.20000  1.0 3.0
   88    93    96    97   0.15000  1.0 3.0
   88    93    96    98   0.15000  1.0 3.0
   88    93    96   103   0.86500  1.0 1.0
   88    93    96   103  -0.17500 -1.0 2.0
   88    93    96   103   0.20800  1.0 3.0
   89    88    93    69   0.15000  1.0 3.0
   89    88    93    61   0.15000  1.0 3.0
   89    88    93    96   0.15000  1.0 3.0
   90    88    93    69   0.15000  1.0 3.0
   90    88    93    61   0.15000  1.0 3.0
   90    88    93    96   0.15000  1.0 3.0
   93    69    74    75   0.15000  1.0 3.0
   93    69    74    76   0.15000  1.0 3.0
   93    69   -74    78   0.56750  1.0 1.0
   93    69   -74    78  -0.07550 -1.0 2.0
   93    69   -74    78   0.20000  1.0 3.0
   93    61    66    67   0.15000  1.0 3.0
   93    61    66    68   0.15000  1.0 3.0
   93    61    66    71   0.56750  1.0 1.0
   93    61    66    71  -0.07550 -1.0 2.0
   93    61    66    71   0.20000  1.0 3.0
   93    96   103   104  -0.11600  1.0 1.0
   93    96   103   104  -0.09450 -1.0 2.0
   93    96   103   104   0.21250  1.0 3.0
   61    54    58    59   0.15000  1.0 3.0
   61    54    58    60   0.15000  1.0 3.0
   61    54   -58    63   0.56750  1.0 1.0
   61    54   -58    63  -0.07550 -1.0 2.0
   61    54   -58    63   0.20000  1.0 3.0
   61    93    96    97   0.15000  1.0 3.0
   61    93    96    98   0.15000  1.0 3.0
   61    93    96   103   0.86500  1.0 1.0
   61    93    96   103  -0.17500 -1.0 2.0
   61    93    96   103   0.20800  1.0 3.0
   61    66    71    72   0.15000  1.0 3.0
   61    66    71    73   0.15000  1.0 3.0
   61    66    71    77   0.56750  1.0 1.0
   61    66    71    77  -0.07550 -1.0 2.0
   61    66    71    77   0.20000  1.0 3.0
   62    61    66    67   0.15000  1.0 3.0
   62    61    66    68   0.15000  1.0 3.0
   62    61    66    71   0.15000  1.0 3.0
   66    71    77    39   0.56750  1.0 1.0
   66    71    77    39  -0.07550 -1.0 2.0
   66    71    77    39   0.20000  1.0 3.0
   66    71   -77    53   0.56750  1.0 1.0
   66    71   -77    53  -0.07550 -1.0 2.0
   66    71   -77    53   0.20000  1.0 3.0
   66    71    77    80   0.56750  1.0 1.0
   66    71    77    80  -0.07550 -1.0 2.0
   66    71    77    80   0.20000  1.0 3.0
   67    66    71    72   0.15000  1.0 3.0
   67    66    71    73   0.15000  1.0 3.0
   67    66    71    77   0.15000  1.0 3.0
   68    66    71    72   0.15000  1.0 3.0
   68    66    71    73   0.15000  1.0 3.0
   68    66    71    77   0.15000  1.0 3.0
   71    77    80    81   0.15000  1.0 3.0
   71    77    80    82   0.15000  1.0 3.0
   71    77    80    83   0.15000  1.0 3.0
   72    71    77    39   0.15000  1.0 3.0
   72    71    77    53   0.15000  1.0 3.0
   72    71    77    80   0.15000  1.0 3.0
   73    71    77    39   0.15000  1.0 3.0
   73    71    77    53   0.15000  1.0 3.0
   73    71    77    80   0.15000  1.0 3.0
   77    39    43    44   0.15000  1.0 3.0
   77    39    43    45   0.15000  1.0 3.0
   77    39   -43    47   0.56750  1.0 1.0
   77    39   -43    47  -0.07550 -1.0 2.0
   77    39   -43    47   0.20000  1.0 3.0
   77    53    54    55   0.15000  1.0 3.0
   77    53    54    58   0.56750  1.0 1.0
   77    53    54    58  -0.07550 -1.0 2.0
   77    53    54    58   0.20000  1.0 3.0
   77    53   -54    61   0.56750  1.0 1.0
   77    53   -54    61  -0.07550 -1.0 2.0
   77    53   -54    61   0.20000  1.0 3.0
   77    53    56    57  -0.11600  1.0 1.0
   77    53    56    57  -0.09450 -1.0 2.0
   77    53    56    57   0.21250  1.0 3.0
   96    93    61    54   0.56750  1.0 1.0
   96    93    61    54  -0.07550 -1.0 2.0
   96    93    61    54   0.20000  1.0 3.0
   96    93    61    62   0.15000  1.0 3.0
   96    93    61    66   0.56750  1.0 1.0
   96    93    61    66  -0.07550 -1.0 2.0
   96    93    61    66   0.20000  1.0 3.0
   97    96   103   104   0.19450  1.0 3.0
   98    96   103   104   0.19450  1.0 3.0
   87    78    84    85   0.23400  1.0 3.0
   87    78    84    86   0.23400  1.0 3.0
   87    78    84    88   0.62750  1.0 1.0
   87    78    84    88  -0.30950 -1.0 2.0
   87    78    84    88   0.27300  1.0 3.0
   87    91    94    95   0.23400  1.0 3.0
   87    91    94    99   0.62750  1.0 1.0
   87    91    94    99  -0.30950 -1.0 2.0
   87    91    94    99   0.27300  1.0 3.0
   87    91    94   101   3.69350  1.0 1.0
   87    91    94   101  -1.82950 -1.0 2.0
   87    91   113   109  -0.81800  1.0 1.0
   91    94    99   100   0.15000  1.0 3.0
   91    94    99   105   3.97050  1.0 1.0
   91    94    99   107   0.86500  1.0 1.0
   91    94    99   107  -0.17500 -1.0 2.0
   91    94    99   107   0.20800  1.0 3.0
   91    94   101   102  -0.11600  1.0 1.0
   91    94   101   102  -0.09450 -1.0 2.0
   91    94   101   102   0.21250  1.0 3.0
   92    91    94    95   0.15000  1.0 3.0
   92    91    94    99   0.15000  1.0 3.0
   92    91    94   101   0.23400  1.0 3.0
   92    91   113   109   0.37050  1.0 3.0
   94    91   113   109   0.06250  1.0 1.0
   94    91   113   109  -0.01100 -1.0 2.0
   94    91   113   109   0.28050  1.0 3.0
   94    99   105   106   0.15000  1.0 3.0
   94    99  -105   109   0.56750  1.0 1.0
   94    99  -105   109  -0.07550 -1.0 2.0
   94    99  -105   109   0.20000  1.0 3.0
   94    99   105   111   0.86500  1.0 1.0
   94    99   105   111  -0.17500 -1.0 2.0
   94    99   105   111   0.20800  1.0 3.0
   94    99   107   108  -0.11600  1.0 1.0
   94    99   107   108  -0.09450 -1.0 2.0
   94    99   107   108   0.21250  1.0 3.0
   95    94    99   100   0.15000  1.0 3.0
   95    94    99   105   0.15000  1.0 3.0
   95    94    99   107   0.23400  1.0 3.0
   95    94   101   102   0.19450  1.0 3.0
   99    94   101   102  -0.11600  1.0 1.0
   99    94   101   102  -0.09450 -1.0 2.0
   99    94   101   102   0.21250  1.0 3.0
   99   105   109   110   0.15000  1.0 3.0
   99   105   109   113   0.62750  1.0 1.0
   99   105   109   113  -0.30950 -1.0 2.0
   99   105   109   113   0.27300  1.0 3.0
   99   105   109   114   0.56750  1.0 1.0
   99   105   109   114  -0.07550 -1.0 2.0
   99   105   109   114   0.20000  1.0 3.0
   99   105   111   112  -0.11600  1.0 1.0
   99   105   111   112  -0.09450 -1.0 2.0
   99   105   111   112   0.21250  1.0 3.0
  100    99   105   106   0.15000  1.0 3.0
  100    99   105   109   0.15000  1.0 3.0
  100    99   105   111   0.23400  1.0 3.0
  100    99   107   108   0.19450  1.0 3.0
  105    99   107   108  -0.11600  1.0 1.0
  105    99   107   108  -0.09450 -1.0 2.0
  105    99   107   108   0.21250  1.0 3.0
  105   109  -113    91   0.06250  1.0 1.0
  105   109  -113    91  -0.01100 -1.0 2.0
  105   109  -113    91   0.28050  1.0 3.0
  105   109   114   115   0.15000  1.0 3.0
  105   109   114   116   0.15000  1.0 3.0
  105   109   114   117   0.15000  1.0 3.0
  106   105   109   110   0.15000  1.0 3.0
  106   105   109   113   0.23400  1.0 3.0
  106   105   109   114   0.15000  1.0 3.0
  106   105   111   112   0.19450  1.0 3.0
  109   105   111   112  -0.11600  1.0 1.0
  109   105   111   112  -0.09450 -1.0 2.0
  109   105   111   112   0.21250  1.0 3.0
  110   109   113    91   0.37050  1.0 3.0
  110   109   114   115   0.15000  1.0 3.0
  110   109   114   116   0.15000  1.0 3.0
  110   109   114   117   0.15000  1.0 3.0
  113    91    94    95   0.23400  1.0 3.0
  113    91   -94    99   0.62750  1.0 1.0
  113    91   -94    99  -0.30950 -1.0 2.0
  113    91   -94    99   0.27300  1.0 3.0
  113    91    94   101   3.69350  1.0 1.0
  113    91    94   101  -1.82950 -1.0 2.0
  113   109   114   115   0.23400  1.0 3.0
  113   109   114   116   0.23400  1.0 3.0
  113   109   114   117   0.23400  1.0 3.0
  114   109   113    91   0.06250  1.0 1.0
  114   109   113    91  -0.01100 -1.0 2.0
  114   109   113    91   0.28050  1.0 3.0
  111   105   109   110   0.23400  1.0 3.0
  111   105   109   113   3.69350  1.0 1.0
  111   105   109   113  -1.82950 -1.0 2.0
  111   105   109   114   0.86500  1.0 1.0
  111   105   109   114  -0.17500 -1.0 2.0
  111   105   109   114   0.20800  1.0 3.0
  107    99   105   106   0.23400  1.0 3.0
  107    99   105   109   0.86500  1.0 1.0
  107    99   105   109  -0.17500 -1.0 2.0
  107    99   105   109   0.20800  1.0 3.0
  107    99   105   111   3.75450  1.0 1.0
  101    94    99   100   0.23400  1.0 3.0
  101    94    99   105   0.86500  1.0 1.0
  101    94    99   105  -0.17500 -1.0 2.0
  101    94    99   105   0.20800  1.0 3.0
  101    94    99   107   3.75450  1.0 1.0
   56    53    54    55   0.23400  1.0 3.0
   56    53    54    58   0.86500  1.0 1.0
   56    53    54    58  -0.17500 -1.0 2.0
   56    53    54    58   0.20800  1.0 3.0
   56    53    54    61   0.86500  1.0 1.0
   56    53    54    61  -0.17500 -1.0 2.0
   56    53    54    61   0.20800  1.0 3.0
   56    53    77    39   0.86500  1.0 1.0
   56    53    77    39  -0.17500 -1.0 2.0
   56    53    77    39   0.20800  1.0 3.0
   56    53    77    71   0.86500  1.0 1.0
   56    53    77    71  -0.17500 -1.0 2.0
   56    53    77    71   0.20800  1.0 3.0
   56    53    77    80   0.86500  1.0 1.0
   56    53    77    80  -0.17500 -1.0 2.0
   56    53    77    80   0.20800  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    38    37    41   1.10000 -1.0 2.0
   42    46    41    37   1.10000 -1.0 2.0
END
