* LIGAND DATABASE FILE (OPLS2005)
*
001     117   120    235    384     718
    1     0 S   NP   _N1_     1    29.47245    99.10209   -16.01974
    2     1 S   H    _HN1     2     1.02777    56.98441   -92.18336
    3     1 S   H    _H1_     3     1.02959    81.44924    26.32594
    4     1 S   H    _H2_     4     1.02836    69.31973   138.23152
    5     1 S   CT   _CA1     5     1.50141   166.92227  -129.02964
    6     5 S   HC   _HA1     6     1.09577   105.19769   -28.68423
    7     5 S   CO3  _C1_     7     1.53803   112.40716  -148.77049
    8     7 S   O2Z  _O11     8     1.26353   115.00895   -42.12190
    9     7 S   O2Z  _O12     9     1.26237   114.93338   136.99853
   10     5 S   CT   _CB1    10     1.53108   107.40196    89.16525
   11    10 S   HC   HB11    11     1.09816   109.29605   -50.67982
   12    10 S   HC   HB12    12     1.09822   110.41240    65.87482
   13    10 S   CT   _CG1    13     1.52981   112.69394  -171.84305
   14    13 S   HC   HG11    14     1.09516   110.22708   -63.81107
   15    13 S   HC   HG12    15     1.09639   110.12584    55.36149
   16    13 S   C    _CD1    16     1.51807   112.41021   175.65589
   17    16 S   O    _OE1    17     1.22721   123.22919    -7.76961
   18    16 S   N    _N2_    18     1.38617   111.62423   172.73194
   19    18 S   H    _HN2    19     1.01593   119.01153     0.53959
   20    18 S   CT1  _CA2    20     1.46313   123.50572  -178.67633
   21    20 S   HC   _HA2    21     1.09737   109.34885   -13.84762
   22    20 S   C    _C2_    22     1.53446   108.38952  -129.51335
   23    22 S   O    _O2_    23     1.23014   122.24647  -146.91863
   24    20 S   CT   _CB2    32     1.53587   111.24598   108.30584
   25    24 S   HC   HB21    33     1.09162   109.00048    54.67249
   26    24 S   HC   HB22    34     1.09450   110.33893   173.23311
   27    22 S   N    _N3_    24     1.38513   113.36080    40.55288
   28    27 S   H    _HN3    25     1.01531   118.87246    -0.84973
   29    24 S   S    _SG2    35     1.82675   111.11149   -67.33157
   30    27 S   CT   _CA3    26     1.45460   123.57939   175.13921
   31    30 S   HC   HA31    27     1.09514   109.38537    21.18310
   32    30 S   HC   HA32    28     1.09499   107.07698   138.20680
   33    29 S   CT   _C8_    36     1.86378   102.20581   162.01148
   34    33 S   HC   _H5_    37     1.09601   102.63952   172.26102
   35    30 S   CO3  _C3_    29     1.52920   113.04580  -102.40419
   36    35 S   O2Z  _O31    30     1.26410   115.38732   -44.74259
   37    35 S   O2Z  _O32    31     1.26353   115.00042   136.19074
   38    33 S   CT   _C9_    38     1.58269   112.73449    58.18397
   39    38 S   HC   _H6_    39     1.09667   106.92833   -63.45490
   40    33 S   CT   _C7_    95     1.56621   112.62477   -73.90141
   41    40 S   HC   _H4_    96     1.09632   106.89681  -162.23838
   42    38 S   CT   _C11    40     1.56981   112.38193  -179.66545
   43    42 S   HC   _H7_    41     1.09530   105.30430    53.95482
   44    38 S   CT   _C10    91     1.54260   110.77479    53.20029
   45    44 S   HC   _H19    92     1.09406   111.76212    58.25872
   46    44 S   HC   _H20    93     1.09368   111.79282   -62.34183
   47    44 S   HC   _H21    94     1.09065   112.40747   179.90309
   48    40 S   CT   _C6_    97     1.57349   118.05832   -42.20137
   49    48 S   HC   _H3_    98     1.09718   107.23162    61.66762
   50    40 S   OH   _O36   116     1.42995   108.05046    83.20789
   51    50 S   HO   _H44   117     0.97227   107.77498   141.92120
   52    42 S   CT   _C12    42     1.55935   113.38373   -62.71192
   53    52 S   HC   _H22    43     1.09589   110.80217   111.75620
   54    52 S   HC   _H23    44     1.09378   112.15596    -7.30997
   55    48 S   CT   _C5_    99     1.55136   109.75393   -55.93783
   56    55 S   HC   _H17   100     1.09625   110.37627   -62.85879
   57    55 S   HC   _H18   101     1.09392   109.50139    52.87149
   58    48 S   CT   _C30   106     1.57137   110.80850   176.23558
   59    58 S   HC   _H45   107     1.09593   107.99013   -40.12641
   60    52 S   CT   _C13    45     1.53439   107.65481  -127.66692
   61    60 S   HC   _H24    46     1.09483   111.37874   141.79200
   62    60 S   HC   _H25    47     1.09460   110.30201   -98.92716
   63    55 S   CT   _C4_   102     1.51979   115.76705   172.18194
   64    63 S   HC   _H14   103     1.09385   111.31391   -45.30346
   65    63 S   HC   _H15   104     1.09546   109.82234  -164.58471
   66    63 S   HC   _H16   105     1.09196   111.64094    77.42032
   67    58 S   CT   _C31   108     1.52998   114.00019    77.93516
   68    67 S   HC   _H46   109     1.09403   111.94452    67.86661
   69    67 S   HC   _H47   110     1.09576   110.34508  -172.74085
   70    67 S   HC   _H48   111     1.09394   111.37997   -53.62135
   71    58 S   CT   _C32   112     1.53321   113.46593  -154.60071
   72    71 S   HC   _H49   113     1.09041   113.16516   -73.37475
   73    71 S   HC   _H50   114     1.09623   110.00868   167.36028
   74    71 S   HC   _H51   115     1.09407   110.91886    48.91465
   75    60 S   CT   _C14    48     1.51919   103.23994    21.32067
   76    75 S   HC   _H8_    49     1.09931   104.91888    72.05342
   77    75 S   CT   _C19    50     1.53603   119.51892  -172.54538
   78    77 S   HC   _H10    51     1.09952   103.50367   -90.06621
   79    77 S   CT   _C20    52     1.53871   117.33022    27.15122
   80    79 S   HC   _H30    53     1.09418   111.08830    57.59773
   81    79 S   HC   _H31    54     1.09472   110.34720   -63.64510
   82    77 S   CT   _C18    70     1.55218   112.02387   154.15996
   83    82 S   HC   _H9_    71     1.09521   105.81369   -81.86158
   84    79 S   CO4  _C21    55     1.52857   110.24293   177.29166
   85    84 S   O    _O33    56     1.22861   121.60533  -171.04248
   86    82 S   CT   _C17    72     1.53498   111.26602    30.83855
   87    86 S   HC   _H28    73     1.09596   110.71176   177.19007
   88    86 S   HC   _H29    74     1.09703   109.54183    59.59297
   89    84 S   CT   _C22    57     1.52195   115.45280    11.10957
   90    89 S   HC   _H11    58     1.10078   103.32775    56.42515
   91    86 S   CT   _C16    75     1.54940   112.61345   -61.60400
   92    91 S   HC   _H26    76     1.09172   107.18609   157.26474
   93    91 S   HC   _H27    77     1.09805   108.13929   -90.74270
   94    89 S   CT   _C27    59     1.52623   116.56993   169.25682
   95    94 S   HC   _H34    60     1.09783   110.25256   -48.67975
   96    94 S   HC   _H35    61     1.09500   112.72555    67.93204
   97    42 S   CT   _C15    78     1.57636   120.10126   173.06096
   98    94 S   CT   _C26    62     1.53454   108.53695  -168.17058
   99    98 S   HC   _H13    63     1.09769   108.30637    65.90246
  100    97 S   CT   _C29    79     1.56207   105.57532  -142.26522
  101   100 S   HC   _H41    80     1.09481   112.53777   -51.77334
  102   100 S   HC   _H42    81     1.08951   113.78015  -173.50575
  103   100 S   HC   _H43    82     1.09733   110.09943    66.93949
  104    98 S   CT   _C25    64     1.53835   113.44078   -53.75491
  105   104 S   HC   _H12    65     1.09654   108.65598   169.43450
  106    98 S   OH   _O34    89     1.42409   110.21263  -177.63677
  107   106 S   HO   _H36    90     0.97218   107.68076   -53.49353
  108   104 S   CT   _C24    66     1.54541   113.06505    47.81868
  109   108 S   HC   _H32    67     1.09781   107.94917    72.88492
  110   108 S   HC   _H33    68     1.09641   108.70471  -171.12958
  111   104 S   OH   _O35    87     1.42703   109.79348   -75.41878
  112   111 S   HO   _H37    88     0.97217   107.61022  -175.84970
  113    89 S   CT   _C23    69     1.55782   110.43962   -59.82106
  114   113 S   CT   _C28    83     1.55481   111.34976   -73.79530
  115   114 S   HC   _H38    84     1.09654   111.23596    62.22009
  116   114 S   HC   _H39    85     1.09030   113.96715   -57.31894
  117   114 S   HC   _H40    86     1.09607   110.60629  -178.27331
  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
  19   8   2   1   1  19   9  15   6  23   9   5   2   1   1  20
   9   3   1  11   6   5  10   6   5  10   8  11   5   4   3   2
   1   1   7   3   2   1   3   2   1   1  19   7  18   9  12   5
   4  21   8  10   4  11   6   5  16   7   8   3   2  12   6   5
   4  11   6   3   2   1   1  10   7   3   1   9   4   3   2   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    42    44    40    41    48    50  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    43    52    97    44    45    46    47    40    41    48    49    55    58    50    51  
   38    39    42    44    40    41    48    50  
   36    37  
   37  
    0  
   39    42    43    52    53    54    60    75    91    97   100    44    45    46    47    40    41    48    50  
   42    43    52    97    44    45    46    47    40  
   41    48    49    55    56    57    63    58    59    67    71    50    51    42    44  
   48    49    55    58    50    51  
   43    52    53    54    60    61    62    75    76    77    86    91    92    93    97   100   101   102   103    44    45    46    47  
   52    53    54    60    75    91    97   100    44  
   45    46    47    52    97  
   46    47  
   47  
    0  
   49    55    56    57    63    64    65    66    58    59    67    68    69    70    71    72    73    74    50    51  
   55    56    57    63    58    59    67    71    50  
   51    55    58  
    0  
   53    54    60    61    62    75    76    77    91    97   100  
   54    60    61    62    75    97  
   60    61    62    75    97  
   56    57    63    64    65    66    58    59    67    71  
   57    63    64    65    66    58  
   63    64    65    66    58  
   59    67    68    69    70    71    72    73    74    63  
   67    68    69    70    71    72    73    74  
   61    62    75    76    77    78    79    82    91    97   100  
   62    75    76    77    97  
   75    76    77    97  
   64    65    66  
   65    66  
   66  
    0  
   68    69    70    71    72    73    74  
   69    70    71  
   70    71  
   71  
   72    73    74  
   73    74  
   74  
    0  
   76    77    78    79    80    81    84   113    82    83    86    91    92    93    97   100   101   102   103  
   77    78    79    82    91    97   100  
   78    79    80    81    84    85    89   108   113    82    83    86    87    88    91    97   100   114  
   79    80    81    84   113    82    83    86    97  
   80    81    84    85    89    90    94   113    82    83    86    97  
   81    84    85    89    82  
   84    85    89    82  
   83    86    87    88    91    92    93    97   114   115   116   117    84    89    90    94   104   108   109   110   113  
   86    87    88    91   114    89   108   113  
   85    89    90    94    95    96    98   108   113   114  
   89    90    94   113  
   87    88    91    92    93    97   100   114    89   108   113  
   88    91    92    93    97   113  
   91    92    93    97   113  
   90    94    95    96    98    99   104   108   109   110   113   114   115   116   117   106  
   94    95    96    98   108   113   114  
   92    93    97   100   101   102   103   113  
   93    97   100  
   97   100  
   95    96    98    99   104   105   108   113   114   111   106   107  
   96    98    99   104   113   106  
   98    99   104   113   106  
  100   101   102   103  
   99   104   105   108   109   110   113   111   112   106   107  
  104   105   108   111   106   107  
  101   102   103  
  102   103  
  103  
    0  
  105   108   109   110   113   114   111   112   106   107  
  108   109   110   113   111   112   106  
  107   108   111  
    0  
  109   110   113   114   115   116   117   111   112  
  110   113   114   111  
  113   114   111  
  112   113  
    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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   51   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   52   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   85   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   86   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   98   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
  105   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  107   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  108   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   2.5000   0.0300   0.060000   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   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
  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    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   340.000  1.090
   33    38   268.000  1.529
   33    40   268.000  1.529
   38    39   340.000  1.090
   38    42   268.000  1.529
   38    44   268.000  1.529
   42    43   340.000  1.090
   42    52   268.000  1.529
   42    97   268.000  1.529
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    60   268.000  1.529
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    75   268.000  1.529
   75    76   340.000  1.090
   75    77   268.000  1.529
   75    97   268.000  1.529
   77    78   340.000  1.090
   77    79   268.000  1.529
   77    82   268.000  1.529
   79    80   340.000  1.090
   79    81   340.000  1.090
   79    84   317.000  1.522
   84    85   570.000  1.229
   84    89   317.000  1.522
   89    90   340.000  1.090
   89    94   268.000  1.529
   89   113   268.000  1.529
   94    95   340.000  1.090
   94    96   340.000  1.090
   94    98   268.000  1.529
   98    99   340.000  1.090
   98   104   268.000  1.529
   98   106   320.000  1.410
  104   105   340.000  1.090
  104   108   268.000  1.529
  104   111   320.000  1.410
  108   109   340.000  1.090
  108   110   340.000  1.090
  108   113   268.000  1.529
  113    82   268.000  1.529
  113   114   268.000  1.529
   82    83   340.000  1.090
   82    86   268.000  1.529
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    91   268.000  1.529
   91    92   340.000  1.090
   91    93   340.000  1.090
   91    97   268.000  1.529
   97   100   268.000  1.529
  100   101   340.000  1.090
  100   102   340.000  1.090
  100   103   340.000  1.090
  114   115   340.000  1.090
  114   116   340.000  1.090
  114   117   340.000  1.090
  111   112   553.000  0.945
  106   107   553.000  0.945
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   340.000  1.090
   40    41   340.000  1.090
   40    48   268.000  1.529
   40    50   320.000  1.410
   48    49   340.000  1.090
   48    55   268.000  1.529
   48    58   268.000  1.529
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    63   268.000  1.529
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   340.000  1.090
   58    59   340.000  1.090
   58    67   268.000  1.529
   58    71   268.000  1.529
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   340.000  1.090
   50    51   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    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    42    58.35000  112.70000
   33    38    44    58.35000  112.70000
   33    40    41    37.50000  110.70000
   33    40    48    58.35000  112.70000
   33    40    50    50.00000  109.50000
   38    33    34    37.50000  110.70000
   38    42    43    37.50000  110.70000
   38    42    52    58.35000  112.70000
   38    42    97    58.35000  112.70000
   38    44    45    37.50000  110.70000
   38    44    46    37.50000  110.70000
   38    44    47    37.50000  110.70000
   42    38    39    37.50000  110.70000
   42    52    53    37.50000  110.70000
   42    52    54    37.50000  110.70000
   42    52    60    58.35000  112.70000
   42    97    75    58.35000  112.70000
   42    97    91    58.35000  112.70000
   42    97   100    58.35000  112.70000
   52    42    43    37.50000  110.70000
   52    60    61    37.50000  110.70000
   52    60    62    37.50000  110.70000
   52    60    75    58.35000  112.70000
   54    52    53    33.00000  107.80000
   60    52    53    37.50000  110.70000
   60    52    54    37.50000  110.70000
   60    75    76    37.50000  110.70000
   60    75    77    58.35000  112.70000
   60    75    97    58.35000  112.70000
   62    60    61    33.00000  107.80000
   75    60    61    37.50000  110.70000
   75    60    62    37.50000  110.70000
   75    77    78    37.50000  110.70000
   75    77    79    58.35000  112.70000
   75    77    82    58.35000  112.70000
   75    97    91    58.35000  112.70000
   75    97   100    58.35000  112.70000
   77    75    76    37.50000  110.70000
   77    79    80    37.50000  110.70000
   77    79    81    37.50000  110.70000
   77    79    84    63.00000  111.10000
   77    82   113    58.35000  112.70000
   77    82    83    37.50000  110.70000
   77    82    86    58.35000  112.70000
   79    77    78    37.50000  110.70000
   79    84    85    80.00000  120.40000
   79    84    89    70.00000  116.00000
   81    79    80    33.00000  107.80000
   84    79    80    35.00000  109.50000
   84    79    81    35.00000  109.50000
   84    89    90    35.00000  109.50000
   84    89    94    63.00000  111.10000
   84    89   113    63.00000  111.10000
   89    84    85    80.00000  120.40000
   89    94    95    37.50000  110.70000
   89    94    96    37.50000  110.70000
   89    94    98    58.35000  112.70000
   89   113   108    58.35000  112.70000
   89   113    82    58.35000  112.70000
   89   113   114    58.35000  112.70000
   94    89    90    37.50000  110.70000
   94    98    99    37.50000  110.70000
   94    98   104    58.35000  112.70000
   94    98   106    50.00000  109.50000
   96    94    95    33.00000  107.80000
   98    94    95    37.50000  110.70000
   98    94    96    37.50000  110.70000
   98   104   105    37.50000  110.70000
   98   104   108    58.35000  112.70000
   98   104   111    50.00000  109.50000
   98   106   107    55.00000  108.50000
  104    98    99    37.50000  110.70000
  104   108   109    37.50000  110.70000
  104   108   110    37.50000  110.70000
  104   108   113    58.35000  112.70000
  104   111   112    55.00000  108.50000
  108   104   105    37.50000  110.70000
  108   113    82    58.35000  112.70000
  108   113   114    58.35000  112.70000
  110   108   109    33.00000  107.80000
  113    89    90    37.50000  110.70000
  113    89    94    58.35000  112.70000
  113   108   109    37.50000  110.70000
  113   108   110    37.50000  110.70000
  113    82    83    37.50000  110.70000
  113    82    86    58.35000  112.70000
  113   114   115    37.50000  110.70000
  113   114   116    37.50000  110.70000
  113   114   117    37.50000  110.70000
   82    77    78    37.50000  110.70000
   82    77    79    58.35000  112.70000
   82    86    87    37.50000  110.70000
   82    86    88    37.50000  110.70000
   82    86    91    58.35000  112.70000
   86    82    83    37.50000  110.70000
   86    91    92    37.50000  110.70000
   86    91    93    37.50000  110.70000
   86    91    97    58.35000  112.70000
   88    86    87    33.00000  107.80000
   91    86    87    37.50000  110.70000
   91    86    88    37.50000  110.70000
   91    97   100    58.35000  112.70000
   93    91    92    33.00000  107.80000
   97    42    43    37.50000  110.70000
   97    42    52    58.35000  112.70000
   97    75    76    37.50000  110.70000
   97    75    77    58.35000  112.70000
   97    91    92    37.50000  110.70000
   97    91    93    37.50000  110.70000
   97   100   101    37.50000  110.70000
   97   100   102    37.50000  110.70000
   97   100   103    37.50000  110.70000
  102   100   101    33.00000  107.80000
  103   100   101    33.00000  107.80000
  103   100   102    33.00000  107.80000
  114   113    82    58.35000  112.70000
  116   114   115    33.00000  107.80000
  117   114   115    33.00000  107.80000
  117   114   116    33.00000  107.80000
  111   104   105    35.00000  109.50000
  111   104   108    50.00000  109.50000
  106    98    99    35.00000  109.50000
  106    98   104    50.00000  109.50000
   44    38    39    37.50000  110.70000
   44    38    42    58.35000  112.70000
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    33.00000  107.80000
   40    33    34    37.50000  110.70000
   40    33    38    58.35000  112.70000
   40    48    49    37.50000  110.70000
   40    48    55    58.35000  112.70000
   40    48    58    58.35000  112.70000
   40    50    51    55.00000  108.50000
   48    40    41    37.50000  110.70000
   48    55    56    37.50000  110.70000
   48    55    57    37.50000  110.70000
   48    55    63    58.35000  112.70000
   48    58    59    37.50000  110.70000
   48    58    67    58.35000  112.70000
   48    58    71    58.35000  112.70000
   55    48    49    37.50000  110.70000
   55    63    64    37.50000  110.70000
   55    63    65    37.50000  110.70000
   55    63    66    37.50000  110.70000
   57    55    56    33.00000  107.80000
   63    55    56    37.50000  110.70000
   63    55    57    37.50000  110.70000
   65    63    64    33.00000  107.80000
   66    63    64    33.00000  107.80000
   66    63    65    33.00000  107.80000
   58    48    49    37.50000  110.70000
   58    48    55    58.35000  112.70000
   58    67    68    37.50000  110.70000
   58    67    69    37.50000  110.70000
   58    67    70    37.50000  110.70000
   58    71    72    37.50000  110.70000
   58    71    73    37.50000  110.70000
   58    71    74    37.50000  110.70000
   67    58    59    37.50000  110.70000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   71    58    59    37.50000  110.70000
   71    58    67    58.35000  112.70000
   73    71    72    33.00000  107.80000
   74    71    72    33.00000  107.80000
   74    71    73    33.00000  107.80000
   50    40    41    35.00000  109.50000
   50    40    48    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    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   0.32350  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    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   0.21350  1.0 3.0
   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    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    38    44   0.44750  1.0 1.0
   29    33    38    44  -0.17800 -1.0 2.0
   29    33    38    44   0.20200  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    48   0.44750  1.0 1.0
   29    33    40    48  -0.17800 -1.0 2.0
   29    33    40    48   0.20200  1.0 3.0
   29    33    40    50   0.56750  1.0 1.0
   29    33    40    50  -0.07550 -1.0 2.0
   29    33    40    50   0.20000  1.0 3.0
   33    38    42    43   0.15000  1.0 3.0
   33    38    42    52   0.56750  1.0 1.0
   33    38    42    52  -0.07550 -1.0 2.0
   33    38    42    52   0.20000  1.0 3.0
   33    38    42    97   0.56750  1.0 1.0
   33    38    42    97  -0.07550 -1.0 2.0
   33    38    42    97   0.20000  1.0 3.0
   33    38    44    45   0.15000  1.0 3.0
   33    38    44    46   0.15000  1.0 3.0
   33    38    44    47   0.15000  1.0 3.0
   33    40    48    49   0.15000  1.0 3.0
   33    40    48    55   0.56750  1.0 1.0
   33    40    48    55  -0.07550 -1.0 2.0
   33    40    48    55   0.20000  1.0 3.0
   33    40    48    58   0.56750  1.0 1.0
   33    40    48    58  -0.07550 -1.0 2.0
   33    40    48    58   0.20000  1.0 3.0
   33    40    50    51  -0.11600  1.0 1.0
   33    40    50    51  -0.09450 -1.0 2.0
   33    40    50    51   0.21250  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    42   0.15000  1.0 3.0
   34    33    38    44   0.15000  1.0 3.0
   34    33    40    41   0.15000  1.0 3.0
   34    33    40    48   0.15000  1.0 3.0
   34    33    40    50   0.23400  1.0 3.0
   38    33    40    41   0.15000  1.0 3.0
   38    33    40    48   0.56750  1.0 1.0
   38    33    40    48  -0.07550 -1.0 2.0
   38    33    40    48   0.20000  1.0 3.0
   38    33    40    50   0.86500  1.0 1.0
   38    33    40    50  -0.17500 -1.0 2.0
   38    33    40    50   0.20800  1.0 3.0
   38    42    52    53   0.15000  1.0 3.0
   38    42    52    54   0.15000  1.0 3.0
   38    42    52    60   0.56750  1.0 1.0
   38    42    52    60  -0.07550 -1.0 2.0
   38    42    52    60   0.20000  1.0 3.0
   38    42    97    75   0.56750  1.0 1.0
   38    42    97    75  -0.07550 -1.0 2.0
   38    42    97    75   0.20000  1.0 3.0
   38    42    97    91   0.56750  1.0 1.0
   38    42    97    91  -0.07550 -1.0 2.0
   38    42    97    91   0.20000  1.0 3.0
   38    42    97   100   0.56750  1.0 1.0
   38    42    97   100  -0.07550 -1.0 2.0
   38    42    97   100   0.20000  1.0 3.0
   39    38    42    43   0.15000  1.0 3.0
   39    38    42    52   0.15000  1.0 3.0
   39    38    42    97   0.15000  1.0 3.0
   39    38    44    45   0.15000  1.0 3.0
   39    38    44    46   0.15000  1.0 3.0
   39    38    44    47   0.15000  1.0 3.0
   42    38    44    45   0.15000  1.0 3.0
   42    38    44    46   0.15000  1.0 3.0
   42    38    44    47   0.15000  1.0 3.0
   42    52    60    61   0.15000  1.0 3.0
   42    52    60    62   0.15000  1.0 3.0
   42    52   -60    75   0.56750  1.0 1.0
   42    52   -60    75  -0.07550 -1.0 2.0
   42    52   -60    75   0.20000  1.0 3.0
   42    97   100   101   0.15000  1.0 3.0
   42    97   100   102   0.15000  1.0 3.0
   42    97   100   103   0.15000  1.0 3.0
   43    42    52    53   0.15000  1.0 3.0
   43    42    52    54   0.15000  1.0 3.0
   43    42    52    60   0.15000  1.0 3.0
   43    42    97    75   0.15000  1.0 3.0
   43    42    97    91   0.15000  1.0 3.0
   43    42    97   100   0.15000  1.0 3.0
   52    42   -97    75   0.56750  1.0 1.0
   52    42   -97    75  -0.07550 -1.0 2.0
   52    42   -97    75   0.20000  1.0 3.0
   52    42    97    91   0.56750  1.0 1.0
   52    42    97    91  -0.07550 -1.0 2.0
   52    42    97    91   0.20000  1.0 3.0
   52    42    97   100   0.56750  1.0 1.0
   52    42    97   100  -0.07550 -1.0 2.0
   52    42    97   100   0.20000  1.0 3.0
   52    60    75    76   0.15000  1.0 3.0
   52    60    75    77   0.56750  1.0 1.0
   52    60    75    77  -0.07550 -1.0 2.0
   52    60    75    77   0.20000  1.0 3.0
   52    60   -75    97   0.56750  1.0 1.0
   52    60   -75    97  -0.07550 -1.0 2.0
   52    60   -75    97   0.20000  1.0 3.0
   53    52    60    61   0.15000  1.0 3.0
   53    52    60    62   0.15000  1.0 3.0
   53    52    60    75   0.15000  1.0 3.0
   54    52    60    61   0.15000  1.0 3.0
   54    52    60    62   0.15000  1.0 3.0
   54    52    60    75   0.15000  1.0 3.0
   60    75    77    78   0.15000  1.0 3.0
   60    75    77    79   0.56750  1.0 1.0
   60    75    77    79  -0.07550 -1.0 2.0
   60    75    77    79   0.20000  1.0 3.0
   60    75    77    82   0.56750  1.0 1.0
   60    75    77    82  -0.07550 -1.0 2.0
   60    75    77    82   0.20000  1.0 3.0
   60    75   -97    42   0.56750  1.0 1.0
   60    75   -97    42  -0.07550 -1.0 2.0
   60    75   -97    42   0.20000  1.0 3.0
   60    75    97    91   0.56750  1.0 1.0
   60    75    97    91  -0.07550 -1.0 2.0
   60    75    97    91   0.20000  1.0 3.0
   60    75    97   100   0.56750  1.0 1.0
   60    75    97   100  -0.07550 -1.0 2.0
   60    75    97   100   0.20000  1.0 3.0
   61    60    75    76   0.15000  1.0 3.0
   61    60    75    77   0.15000  1.0 3.0
   61    60    75    97   0.15000  1.0 3.0
   62    60    75    76   0.15000  1.0 3.0
   62    60    75    77   0.15000  1.0 3.0
   62    60    75    97   0.15000  1.0 3.0
   75    77    79    80   0.15000  1.0 3.0
   75    77    79    81   0.15000  1.0 3.0
   75    77    79    84  -0.95700  1.0 1.0
   75    77    79    84  -0.18200 -1.0 2.0
   75    77    79    84   0.29450  1.0 3.0
   75    77    82   113   0.56750  1.0 1.0
   75    77    82   113  -0.07550 -1.0 2.0
   75    77    82   113   0.20000  1.0 3.0
   75    77    82    83   0.15000  1.0 3.0
   75    77    82    86   0.56750  1.0 1.0
   75    77    82    86  -0.07550 -1.0 2.0
   75    77    82    86   0.20000  1.0 3.0
   75    97   100   101   0.15000  1.0 3.0
   75    97   100   102   0.15000  1.0 3.0
   75    97   100   103   0.15000  1.0 3.0
   76    75    77    78   0.15000  1.0 3.0
   76    75    77    79   0.15000  1.0 3.0
   76    75    77    82   0.15000  1.0 3.0
   76    75    97    42   0.15000  1.0 3.0
   76    75    97    91   0.15000  1.0 3.0
   76    75    97   100   0.15000  1.0 3.0
   77    75    97    42   0.56750  1.0 1.0
   77    75    97    42  -0.07550 -1.0 2.0
   77    75    97    42   0.20000  1.0 3.0
   77    75    97    91   0.56750  1.0 1.0
   77    75    97    91  -0.07550 -1.0 2.0
   77    75    97    91   0.20000  1.0 3.0
   77    75    97   100   0.56750  1.0 1.0
   77    75    97   100  -0.07550 -1.0 2.0
   77    75    97   100   0.20000  1.0 3.0
   77    79    84    85   0.30150 -1.0 2.0
   77    79    84    89   0.60050  1.0 1.0
   77    79    84    89   0.05600 -1.0 2.0
   77    79    84    89   0.26150  1.0 3.0
   77    82    86    87   0.15000  1.0 3.0
   77    82    86    88   0.15000  1.0 3.0
   77    82   -86    91   0.56750  1.0 1.0
   77    82   -86    91  -0.07550 -1.0 2.0
   77    82   -86    91   0.20000  1.0 3.0
   78    77    79    80   0.15000  1.0 3.0
   78    77    79    81   0.15000  1.0 3.0
   78    77    79    84  -0.11250  1.0 3.0
   78    77    82   113   0.15000  1.0 3.0
   78    77    82    83   0.15000  1.0 3.0
   78    77    82    86   0.15000  1.0 3.0
   79    77    82   113   0.56750  1.0 1.0
   79    77    82   113  -0.07550 -1.0 2.0
   79    77    82   113   0.20000  1.0 3.0
   79    77    82    83   0.15000  1.0 3.0
   79    77    82    86   0.56750  1.0 1.0
   79    77    82    86  -0.07550 -1.0 2.0
   79    77    82    86   0.20000  1.0 3.0
   79    84    89    90   0.00000  1.0 1.0
   79    84    89    94   0.60050  1.0 1.0
   79    84    89    94   0.05600 -1.0 2.0
   79    84    89    94   0.26150  1.0 3.0
   79    84   -89   113   0.60050  1.0 1.0
   79    84   -89   113   0.05600 -1.0 2.0
   79    84   -89   113   0.26150  1.0 3.0
   80    79    84    85   0.00000  1.0 1.0
   80    79    84    89   0.00000  1.0 1.0
   81    79    84    85   0.00000  1.0 1.0
   81    79    84    89   0.00000  1.0 1.0
   84    89    94    95  -0.11250  1.0 3.0
   84    89    94    96  -0.11250  1.0 3.0
   84    89    94    98  -0.95700  1.0 1.0
   84    89    94    98  -0.18200 -1.0 2.0
   84    89    94    98   0.29450  1.0 3.0
   84    89   113   108  -0.95700  1.0 1.0
   84    89   113   108  -0.18200 -1.0 2.0
   84    89   113   108   0.29450  1.0 3.0
   84    89   113    82  -0.95700  1.0 1.0
   84    89   113    82  -0.18200 -1.0 2.0
   84    89   113    82   0.29450  1.0 3.0
   84    89   113   114  -0.95700  1.0 1.0
   84    89   113   114  -0.18200 -1.0 2.0
   84    89   113   114   0.29450  1.0 3.0
   85    84    89    90   0.00000  1.0 1.0
   85    84    89    94   0.30150 -1.0 2.0
   85    84    89   113   0.30150 -1.0 2.0
   89    94    98    99   0.15000  1.0 3.0
   89    94    98   104   0.56750  1.0 1.0
   89    94    98   104  -0.07550 -1.0 2.0
   89    94    98   104   0.20000  1.0 3.0
   89    94    98   106   0.86500  1.0 1.0
   89    94    98   106  -0.17500 -1.0 2.0
   89    94    98   106   0.20800  1.0 3.0
   89   113   -82    77   0.56750  1.0 1.0
   89   113   -82    77  -0.07550 -1.0 2.0
   89   113   -82    77   0.20000  1.0 3.0
   89   113    82    83   0.15000  1.0 3.0
   89   113    82    86   0.56750  1.0 1.0
   89   113    82    86  -0.07550 -1.0 2.0
   89   113    82    86   0.20000  1.0 3.0
   89   113   114   115   0.15000  1.0 3.0
   89   113   114   116   0.15000  1.0 3.0
   89   113   114   117   0.15000  1.0 3.0
   90    89    94    95   0.15000  1.0 3.0
   90    89    94    96   0.15000  1.0 3.0
   90    89    94    98   0.15000  1.0 3.0
   90    89   113   108   0.15000  1.0 3.0
   90    89   113    82   0.15000  1.0 3.0
   90    89   113   114   0.15000  1.0 3.0
   94    89   113   108   0.56750  1.0 1.0
   94    89   113   108  -0.07550 -1.0 2.0
   94    89   113   108   0.20000  1.0 3.0
   94    89   113    82   0.56750  1.0 1.0
   94    89   113    82  -0.07550 -1.0 2.0
   94    89   113    82   0.20000  1.0 3.0
   94    89   113   114   0.56750  1.0 1.0
   94    89   113   114  -0.07550 -1.0 2.0
   94    89   113   114   0.20000  1.0 3.0
   94    98   104   105   0.15000  1.0 3.0
   94    98  -104   108   0.56750  1.0 1.0
   94    98  -104   108  -0.07550 -1.0 2.0
   94    98  -104   108   0.20000  1.0 3.0
   94    98   104   111   0.86500  1.0 1.0
   94    98   104   111  -0.17500 -1.0 2.0
   94    98   104   111   0.20800  1.0 3.0
   94    98   106   107  -0.11600  1.0 1.0
   94    98   106   107  -0.09450 -1.0 2.0
   94    98   106   107   0.21250  1.0 3.0
   95    94    98    99   0.15000  1.0 3.0
   95    94    98   104   0.15000  1.0 3.0
   95    94    98   106   0.23400  1.0 3.0
   96    94    98    99   0.15000  1.0 3.0
   96    94    98   104   0.15000  1.0 3.0
   96    94    98   106   0.23400  1.0 3.0
   98   104   108   109   0.15000  1.0 3.0
   98   104   108   110   0.15000  1.0 3.0
   98   104   108   113   0.56750  1.0 1.0
   98   104   108   113  -0.07550 -1.0 2.0
   98   104   108   113   0.20000  1.0 3.0
   98   104   111   112  -0.11600  1.0 1.0
   98   104   111   112  -0.09450 -1.0 2.0
   98   104   111   112   0.21250  1.0 3.0
   99    98   104   105   0.15000  1.0 3.0
   99    98   104   108   0.15000  1.0 3.0
   99    98   104   111   0.23400  1.0 3.0
   99    98   106   107   0.19450  1.0 3.0
  104    98   106   107  -0.11600  1.0 1.0
  104    98   106   107  -0.09450 -1.0 2.0
  104    98   106   107   0.21250  1.0 3.0
  104   108  -113    89   0.56750  1.0 1.0
  104   108  -113    89  -0.07550 -1.0 2.0
  104   108  -113    89   0.20000  1.0 3.0
  104   108   113    82   0.56750  1.0 1.0
  104   108   113    82  -0.07550 -1.0 2.0
  104   108   113    82   0.20000  1.0 3.0
  104   108   113   114   0.56750  1.0 1.0
  104   108   113   114  -0.07550 -1.0 2.0
  104   108   113   114   0.20000  1.0 3.0
  105   104   108   109   0.15000  1.0 3.0
  105   104   108   110   0.15000  1.0 3.0
  105   104   108   113   0.15000  1.0 3.0
  105   104   111   112   0.19450  1.0 3.0
  108   104   111   112  -0.11600  1.0 1.0
  108   104   111   112  -0.09450 -1.0 2.0
  108   104   111   112   0.21250  1.0 3.0
  108   113    82    77   0.56750  1.0 1.0
  108   113    82    77  -0.07550 -1.0 2.0
  108   113    82    77   0.20000  1.0 3.0
  108   113    82    83   0.15000  1.0 3.0
  108   113    82    86   0.56750  1.0 1.0
  108   113    82    86  -0.07550 -1.0 2.0
  108   113    82    86   0.20000  1.0 3.0
  108   113   114   115   0.15000  1.0 3.0
  108   113   114   116   0.15000  1.0 3.0
  108   113   114   117   0.15000  1.0 3.0
  109   108   113    89   0.15000  1.0 3.0
  109   108   113    82   0.15000  1.0 3.0
  109   108   113   114   0.15000  1.0 3.0
  110   108   113    89   0.15000  1.0 3.0
  110   108   113    82   0.15000  1.0 3.0
  110   108   113   114   0.15000  1.0 3.0
  113    89    94    95   0.15000  1.0 3.0
  113    89    94    96   0.15000  1.0 3.0
  113    89   -94    98   0.56750  1.0 1.0
  113    89   -94    98  -0.07550 -1.0 2.0
  113    89   -94    98   0.20000  1.0 3.0
  113    82    86    87   0.15000  1.0 3.0
  113    82    86    88   0.15000  1.0 3.0
  113    82    86    91   0.56750  1.0 1.0
  113    82    86    91  -0.07550 -1.0 2.0
  113    82    86    91   0.20000  1.0 3.0
   82    77    79    80   0.15000  1.0 3.0
   82    77    79    81   0.15000  1.0 3.0
   82    77   -79    84  -0.95700  1.0 1.0
   82    77   -79    84  -0.18200 -1.0 2.0
   82    77   -79    84   0.29450  1.0 3.0
   82   113   114   115   0.15000  1.0 3.0
   82   113   114   116   0.15000  1.0 3.0
   82   113   114   117   0.15000  1.0 3.0
   82    86    91    92   0.15000  1.0 3.0
   82    86    91    93   0.15000  1.0 3.0
   82    86    91    97   0.56750  1.0 1.0
   82    86    91    97  -0.07550 -1.0 2.0
   82    86    91    97   0.20000  1.0 3.0
   83    82    86    87   0.15000  1.0 3.0
   83    82    86    88   0.15000  1.0 3.0
   83    82    86    91   0.15000  1.0 3.0
   86    91    97    42   0.56750  1.0 1.0
   86    91    97    42  -0.07550 -1.0 2.0
   86    91    97    42   0.20000  1.0 3.0
   86    91   -97    75   0.56750  1.0 1.0
   86    91   -97    75  -0.07550 -1.0 2.0
   86    91   -97    75   0.20000  1.0 3.0
   86    91    97   100   0.56750  1.0 1.0
   86    91    97   100  -0.07550 -1.0 2.0
   86    91    97   100   0.20000  1.0 3.0
   87    86    91    92   0.15000  1.0 3.0
   87    86    91    93   0.15000  1.0 3.0
   87    86    91    97   0.15000  1.0 3.0
   88    86    91    92   0.15000  1.0 3.0
   88    86    91    93   0.15000  1.0 3.0
   88    86    91    97   0.15000  1.0 3.0
   91    97   100   101   0.15000  1.0 3.0
   91    97   100   102   0.15000  1.0 3.0
   91    97   100   103   0.15000  1.0 3.0
   92    91    97    42   0.15000  1.0 3.0
   92    91    97    75   0.15000  1.0 3.0
   92    91    97   100   0.15000  1.0 3.0
   93    91    97    42   0.15000  1.0 3.0
   93    91    97    75   0.15000  1.0 3.0
   93    91    97   100   0.15000  1.0 3.0
   97    42    52    53   0.15000  1.0 3.0
   97    42    52    54   0.15000  1.0 3.0
   97    42   -52    60   0.56750  1.0 1.0
   97    42   -52    60  -0.07550 -1.0 2.0
   97    42   -52    60   0.20000  1.0 3.0
   97    75    77    78   0.15000  1.0 3.0
   97    75    77    79   0.56750  1.0 1.0
   97    75    77    79  -0.07550 -1.0 2.0
   97    75    77    79   0.20000  1.0 3.0
   97    75   -77    82   0.56750  1.0 1.0
   97    75   -77    82  -0.07550 -1.0 2.0
   97    75   -77    82   0.20000  1.0 3.0
  114   113    82    77   0.56750  1.0 1.0
  114   113    82    77  -0.07550 -1.0 2.0
  114   113    82    77   0.20000  1.0 3.0
  114   113    82    83   0.15000  1.0 3.0
  114   113    82    86   0.56750  1.0 1.0
  114   113    82    86  -0.07550 -1.0 2.0
  114   113    82    86   0.20000  1.0 3.0
  111   104   108   109   0.23400  1.0 3.0
  111   104   108   110   0.23400  1.0 3.0
  111   104   108   113   0.86500  1.0 1.0
  111   104   108   113  -0.17500 -1.0 2.0
  111   104   108   113   0.20800  1.0 3.0
  106    98   104   105   0.23400  1.0 3.0
  106    98   104   108   0.86500  1.0 1.0
  106    98   104   108  -0.17500 -1.0 2.0
  106    98   104   108   0.20800  1.0 3.0
  106    98   104   111   3.75450  1.0 1.0
   44    38    42    43   0.15000  1.0 3.0
   44    38    42    52   0.56750  1.0 1.0
   44    38    42    52  -0.07550 -1.0 2.0
   44    38    42    52   0.20000  1.0 3.0
   44    38    42    97   0.56750  1.0 1.0
   44    38    42    97  -0.07550 -1.0 2.0
   44    38    42    97   0.20000  1.0 3.0
   40    33    38    39   0.15000  1.0 3.0
   40    33    38    42   0.56750  1.0 1.0
   40    33    38    42  -0.07550 -1.0 2.0
   40    33    38    42   0.20000  1.0 3.0
   40    33    38    44   0.56750  1.0 1.0
   40    33    38    44  -0.07550 -1.0 2.0
   40    33    38    44   0.20000  1.0 3.0
   40    48    55    56   0.15000  1.0 3.0
   40    48    55    57   0.15000  1.0 3.0
   40    48    55    63   0.56750  1.0 1.0
   40    48    55    63  -0.07550 -1.0 2.0
   40    48    55    63   0.20000  1.0 3.0
   40    48    58    59   0.15000  1.0 3.0
   40    48    58    67   0.56750  1.0 1.0
   40    48    58    67  -0.07550 -1.0 2.0
   40    48    58    67   0.20000  1.0 3.0
   40    48    58    71   0.56750  1.0 1.0
   40    48    58    71  -0.07550 -1.0 2.0
   40    48    58    71   0.20000  1.0 3.0
   41    40    48    49   0.15000  1.0 3.0
   41    40    48    55   0.15000  1.0 3.0
   41    40    48    58   0.15000  1.0 3.0
   41    40    50    51   0.19450  1.0 3.0
   48    40    50    51  -0.11600  1.0 1.0
   48    40    50    51  -0.09450 -1.0 2.0
   48    40    50    51   0.21250  1.0 3.0
   48    55    63    64   0.15000  1.0 3.0
   48    55    63    65   0.15000  1.0 3.0
   48    55    63    66   0.15000  1.0 3.0
   48    58    67    68   0.15000  1.0 3.0
   48    58    67    69   0.15000  1.0 3.0
   48    58    67    70   0.15000  1.0 3.0
   48    58    71    72   0.15000  1.0 3.0
   48    58    71    73   0.15000  1.0 3.0
   48    58    71    74   0.15000  1.0 3.0
   49    48    55    56   0.15000  1.0 3.0
   49    48    55    57   0.15000  1.0 3.0
   49    48    55    63   0.15000  1.0 3.0
   49    48    58    59   0.15000  1.0 3.0
   49    48    58    67   0.15000  1.0 3.0
   49    48    58    71   0.15000  1.0 3.0
   55    48    58    59   0.15000  1.0 3.0
   55    48    58    67   0.56750  1.0 1.0
   55    48    58    67  -0.07550 -1.0 2.0
   55    48    58    67   0.20000  1.0 3.0
   55    48    58    71   0.56750  1.0 1.0
   55    48    58    71  -0.07550 -1.0 2.0
   55    48    58    71   0.20000  1.0 3.0
   56    55    63    64   0.15000  1.0 3.0
   56    55    63    65   0.15000  1.0 3.0
   56    55    63    66   0.15000  1.0 3.0
   57    55    63    64   0.15000  1.0 3.0
   57    55    63    65   0.15000  1.0 3.0
   57    55    63    66   0.15000  1.0 3.0
   58    48    55    56   0.15000  1.0 3.0
   58    48    55    57   0.15000  1.0 3.0
   58    48    55    63   0.56750  1.0 1.0
   58    48    55    63  -0.07550 -1.0 2.0
   58    48    55    63   0.20000  1.0 3.0
   59    58    67    68   0.15000  1.0 3.0
   59    58    67    69   0.15000  1.0 3.0
   59    58    67    70   0.15000  1.0 3.0
   59    58    71    72   0.15000  1.0 3.0
   59    58    71    73   0.15000  1.0 3.0
   59    58    71    74   0.15000  1.0 3.0
   67    58    71    72   0.15000  1.0 3.0
   67    58    71    73   0.15000  1.0 3.0
   67    58    71    74   0.15000  1.0 3.0
   71    58    67    68   0.15000  1.0 3.0
   71    58    67    69   0.15000  1.0 3.0
   71    58    67    70   0.15000  1.0 3.0
   50    40    48    49   0.23400  1.0 3.0
   50    40    48    55   0.86500  1.0 1.0
   50    40    48    55  -0.17500 -1.0 2.0
   50    40    48    55   0.20800  1.0 3.0
   50    40    48    58   0.86500  1.0 1.0
   50    40    48    58  -0.17500 -1.0 2.0
   50    40    48    58   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
   36    30    35    37  10.50000 -1.0 2.0
   79    89    84    85  10.50000 -1.0 2.0
END
