* LIGAND DATABASE FILE (OPLS2005)
*
001     111   114    203    320     599
    1     0 S   NP   _N1_     1    28.50593    94.42226   -20.15581
    2     1 S   H    _HN1     2     1.02831    33.23202   160.89082
    3     1 S   H    _H1_     3     1.02773    87.76097   -70.63736
    4     1 S   H    _H2_     4     1.02965    89.46239    37.76194
    5     1 S   CT   _CA1     5     1.50158   143.94108   163.08341
    6     5 S   HC   _HA1     6     1.09579   105.17244    57.74571
    7     5 S   CO3  _C1_     7     1.53754   112.54582   -62.24817
    8     7 S   O2Z  _O11     8     1.26350   114.98197   -38.83522
    9     7 S   O2Z  _O12     9     1.26239   114.96146   140.37162
   10     5 S   CT   _CB1    10     1.53105   107.38025   175.57933
   11    10 S   HC   HB11    11     1.09822   109.11794   -51.17260
   12    10 S   HC   HB12    12     1.09815   110.43935    65.27973
   13    10 S   CT   _CG1    13     1.53022   112.83485  -172.36036
   14    13 S   HC   HG11    14     1.09601   110.36024   -67.06214
   15    13 S   HC   HG12    15     1.09656   110.01262    52.19166
   16    13 S   C    _CD1    16     1.51828   112.39314   172.41059
   17    16 S   O    _OE1    17     1.22740   123.26264    -1.81197
   18    16 S   N    _N2_    18     1.38693   111.65790   178.45642
   19    18 S   H    _HN2    19     1.01594   119.04410     0.07402
   20    18 S   CT1  _CA2    20     1.46207   123.27716   179.69545
   21    20 S   HC   _HA2    21     1.09768   109.19807   -13.80742
   22    20 S   C    _C2_    22     1.53414   108.42580  -129.31213
   23    22 S   O    _O2_    23     1.23018   122.21217  -146.35822
   24    20 S   CT   _CB2    32     1.53556   111.91729   108.17416
   25    24 S   HC   HB21    33     1.09554   109.91918    56.37073
   26    24 S   HC   HB22    34     1.09352   109.68021   175.27213
   27    22 S   N    _N3_    24     1.38494   113.36229    41.06672
   28    27 S   H    _HN3    25     1.01526   118.92345    -0.66441
   29    24 S   S    _SG2    35     1.82503   111.28159   -64.13010
   30    27 S   CT   _CA3    26     1.45448   123.45117   174.82036
   31    30 S   HC   HA31    27     1.09524   109.22694    24.54219
   32    30 S   HC   HA32    28     1.09495   107.12607   141.58176
   33    29 S   CT   _C9_    36     1.84480   101.93889  -171.40746
   34    30 S   CO3  _C3_    29     1.52940   113.12105   -98.89991
   35    34 S   O2Z  _O31    30     1.26404   115.42895   -43.04341
   36    34 S   O2Z  _O32    31     1.26358   114.95430   137.85668
   37    33 S   CM   _C10    37     1.53112   108.57800  -163.15900
   38    33 S   OH   _O37   110     1.43381   110.62769   -44.92940
   39    38 S   HO   _H27   111     0.97124   107.97482    71.95978
   40    37 S   CM   _C11    38     1.35497   120.08383  -111.52083
   41    37 S   CT   _C12    73     1.55245   116.24960    73.34655
   42    41 S   HC   _H3_    74     1.09901   106.61424     7.59288
   43    40 S   OS   _O33    39     1.37265   125.43249     3.60967
   44    40 S   OH   _O34    71     1.37699   120.61961  -175.47771
   45    44 S   HO   _H13    72     0.97301   105.05842   176.03988
   46    41 S   CA   _C15    75     1.52919   113.44468  -107.66015
   47    41 S   CT   _C13   103     1.55128   113.00011   120.50247
   48    47 S   HC   _H14   104     1.09443   112.13090    73.74037
   49    47 S   HC   _H15   105     1.09769   109.15219   -44.16062
   50    43 S   CT   _C7_    40     1.43663   120.03508     9.19552
   51    46 S   CA   _C16    76     1.40297   119.46207    99.14862
   52    51 S   HA   _H19    77     1.08711   120.64262     0.99328
   53    47 S   CT   _C14   106     1.52611   112.77982  -164.08744
   54    53 S   HC   _H16   107     1.09463   111.04912    57.47787
   55    53 S   HC   _H17   108     1.09478   109.98945   176.84322
   56    53 S   HC   _H18   109     1.09405   111.58345   -63.63507
   57    33 S   CT   _C8_    41     1.54117   112.21409    74.09790
   58    57 S   HC   _H11    42     1.09884   105.69692  -158.37560
   59    57 S   HC   _H12    43     1.09530   112.09466   -45.98261
   60    50 S   CT   _C27    44     1.55916   105.97925  -154.58972
   61    60 S   HC   _H28    45     1.09931   108.36876   -68.72263
   62    60 S   HC   _H29    46     1.09738   109.85388   175.34486
   63    50 S   CT   _C6_    61     1.55357   106.74171    90.43151
   64    63 S   HC   _H9_    62     1.09502   110.21172   -55.83836
   65    63 S   HC   _H10    63     1.09842   108.22668    56.39288
   66    51 S   CA   _C17    78     1.39248   120.91907  -179.70392
   67    66 S   HA   _H20    79     1.08577   119.96146  -179.70926
   68    60 S   CT   _C28    47     1.53752   115.34362    51.51502
   69    68 S   HC   _H30    48     1.09534   111.05660    64.30350
   70    68 S   HC   _H31    49     1.09655   110.85449   -53.40493
   71    63 S   CT   _C5_    64     1.53110   116.04830   178.01880
   72    71 S   HC   _H7_    65     1.09510   110.18876   -64.08610
   73    71 S   HC   _H8_    66     1.09326   111.22103    54.59996
   74    66 S   CA   _C18    80     1.39350   120.09438    -0.27411
   75    74 S   HA   _H21    81     1.08883   118.53467  -179.27611
   76    68 S   CA   _C29    50     1.50967   111.23052  -174.62345
   77    71 S   CT   _C4_    67     1.52218   111.08378   175.64585
   78    77 S   HC   _H4_    68     1.09479   110.99265   -61.19986
   79    77 S   HC   _H5_    69     1.09449   110.23774   179.14499
   80    77 S   HC   _H6_    70     1.09470   111.01245    59.36811
   81    74 S   CA   _C19    82     1.40327   121.08281     0.07133
   82    76 S   CA   _C30    51     1.40134   120.49750   -88.69462
   83    82 S   HA   _H32    52     1.08715   120.35805    -0.82187
   84    46 S   CA   _C20    83     1.40581   122.61181   -81.72890
   85    84 S   HA   _H22    84     1.08772   119.48010    -1.36916
   86    81 S   NM   _N4_    85     1.35226   121.81044  -178.10679
   87    82 S   CA   _C31    53     1.39570   120.39056   179.11419
   88    87 S   HA   _H33    54     1.08627   119.94902   179.87489
   89    86 S   SY   _S1_    86     1.59820   118.71270   -77.30175
   90    89 S   OY   _O35    87     1.46077   114.62547  -178.39794
   91    89 S   OY   _O36    88     1.46220   116.04644    44.95372
   92    87 S   CA   _C32    55     1.39384   120.07618    -0.23239
   93    92 S   HA   _H34    56     1.08616   120.01712  -179.95154
   94    89 S   CA   _C21    89     1.80062   106.40784   -66.43914
   95    92 S   CA   _C33    57     1.39376   119.96812    -0.10087
   96    95 S   HA   _H35    58     1.08626   119.98808  -179.77794
   97    94 S   CA   _C22    90     1.39000   119.40918   -79.13015
   98    97 S   HA   _H23    91     1.08539   121.49519     1.52341
   99    76 S   CA   _C34    59     1.40164   120.39004    89.84975
  100    99 S   HA   _H36    60     1.08729   120.33364     0.75976
  101    97 S   CA   _C23    92     1.39213   118.52097  -178.54142
  102   101 S   HA   _H24    93     1.08779   119.30716  -179.91377
  103   101 S   CA   _C24    94     1.39810   120.36146     0.41637
  104   103 S   CA   _C25    95     1.39197   118.19661    -0.80211
  105   104 S   HA   _H25    96     1.08204   124.23826  -179.70129
  106   103 S   CT   _C26    99     1.49849   120.45201  -179.97202
  107   106 S   F    F1__   100     1.36094   112.39910    72.14755
  108   106 S   F    F2__   101     1.36137   113.53504  -167.56713
  109   106 S   F    F3__   102     1.36170   112.67151   -47.50049
  110    94 S   NAP  _N5_    97     1.34070   120.46794   102.25705
  111   110 S   H    _H26    98     1.02094   117.80065    -1.24521
  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
  16   2   1   1  19   7   1  11  18   7  14   2   1  13   8   5
   4  17   8   4   3   2   1   1  10   3   2  12   6   5  10   5
   4   6   3   9   4   3   6   5   4   6   3   9   3   2   1   1
   7   8   4   3   1   6   6   3   9   4   3   5   3   9   3   2
   8   4   1   1   9   3   8   7   3   4   2   1   1   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    57    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    50    57    58    59    41    38    39  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    43    50    57    58    59    60    63    44    41    42    46    47    38    39  
   35    36  
   36  
    0  
   40    43    50    57    58    59    44    45    41    42    46    51    84    47    48    49    53    38    39  
   39    40    41    50    57    58    59  
   57  
   43    50    57    60    63    44    45    41    42    46    47  
   42    46    51    52    66    81    84    85    47    48    49    53    54    55    56    43    44    57  
   46    51    84    47    48    49    53  
   50    57    58    59    60    61    62    68    63    64    65    71    44    45  
   45    50  
    0  
   51    52    66    67    74    81    84    85    86    47    48    49    53  
   48    49    53    54    55    56    51    84  
   49    53    54    55    56  
   53    54    55    56  
   57    58    59    60    61    62    68    69    70    76    63    64    65    71    72    73    77  
   52    66    67    74    75    81    84    85  
   66    67    74    84  
   54    55    56  
   55    56  
   56  
    0  
   58    59    60    61    62    68    63    64    65    71  
   59    60    63  
   60    63  
   61    62    68    69    70    76    82    99    63    64    65    71  
   62    68    69    70    76    63  
   68    69    70    76    63  
   64    65    71    72    73    77    78    79    80    68  
   65    71    72    73    77  
   71    72    73    77  
   67    74    75    81    84    86  
   74    75    81  
   69    70    76    82    83    87    95    99   100  
   70    76    82    99  
   76    82    99  
   72    73    77    78    79    80  
   73    77    78    79    80  
   77    78    79    80  
   75    81    84    85    86    89  
   81    84    86  
   82    83    87    88    92    95    96    99   100  
   78    79    80  
   79    80  
   80  
    0  
   84    85    86    89    90    91    94  
   83    87    88    92    93    95    99   100  
   87    88    92    99  
   85    86    89  
   86  
   89    90    91    94    97   110  
   88    92    93    95    96    99  
   92    93    95  
   90    91    94    97    98   101   104   110   111  
   91    94    97   110  
   94    97   110  
   93    95    96    99   100  
   95    96    99  
   97    98   101   102   103   104   105   110   111  
   96    99   100  
   99   100  
   98   101   102   103   104   110   111   106  
  101   102   103   110  
  100  
    0  
  102   103   104   105   110   106   107   108   109  
  103   104   106  
  104   105   110   111   106   107   108   109  
  105   110   111   106   107   108   109  
  110   111   106  
  107   108   109   110  
  108   109  
  109  
    0  
  111  
    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   0.432500   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   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   38   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   39   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   40   3.5500   0.0760   0.133800   2.0020   1.7750   0.023028004  -0.852763146
   41   3.5000   0.0660   0.055000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   44   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   45   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   46   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   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   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   51   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   52   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   53   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.120000   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  -0.120000   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   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   67   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   68   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   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   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   75   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   76   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   77   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5500   0.0700  -0.542400   2.0020   1.7750   0.001000000  -0.843144165
   82   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   83   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   84   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   85   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   86   3.4200   0.1700  -0.252300   1.9310   1.7100   0.005000000   0.000000000
   87   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   88   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   89   3.5500   0.2500   1.355400   2.0020   1.7750   0.025682759  -1.666211680
   90   2.9600   0.1700  -0.784100   1.6780   1.4800   0.001000000  -0.126889456
   91   2.9600   0.1700  -0.784100   1.6780   1.4800   0.001000000  -0.126889456
   92   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   93   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   94   3.5500   0.0700   0.322800   2.5000   1.7750   0.001000000  -0.843144165
   95   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   96   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   97   3.5500   0.0700  -0.240800   2.0020   1.7750   0.001000000  -0.843144165
   98   2.4200   0.0300   0.205100   1.3810   1.2100   0.030040813   0.268726247
   99   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
  100   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
  101   3.5500   0.0700   0.159600   2.0020   1.7750   0.001000000  -0.843144165
  102   2.4200   0.0300   0.157600   1.3810   1.2100   0.030040813   0.268726247
  103   3.5500   0.0700  -0.150700   2.5000   1.7750   0.001000000  -0.843144165
  104   3.5500   0.0700   0.132600   2.0020   1.7750   0.001000000  -0.843144165
  105   2.4200   0.0300   0.182700   1.3810   1.2100   0.030040813   0.268726247
  106   3.2500   0.0620   0.715000   1.9750   1.7500   0.005000000  -0.741685710
  107   2.9400   0.0610  -0.200000   2.4980   2.2250   0.001000000   0.985400000
  108   2.9400   0.0610  -0.200000   2.4980   2.2250   0.001000000   0.985400000
  109   2.9400   0.0610  -0.200000   2.4980   2.2250   0.001000000   0.985400000
  110   3.2500   0.1700  -0.244500   1.9750   1.7500   0.001000000  -0.511443539
  111   0.0000   0.0000   0.368100   0.9960   0.8600   0.030040813  -0.651083722
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    57   268.000  1.529
   33    38   320.000  1.410
   37    40   549.000  1.340
   37    41   317.000  1.510
   40    43   440.000  1.360
   40    44   510.000  1.338
   43    50   320.000  1.410
   50    57   268.000  1.529
   50    60   268.000  1.529
   50    63   268.000  1.529
   57    58   340.000  1.090
   57    59   340.000  1.090
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    68   268.000  1.529
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    76   317.000  1.510
   76    82   469.000  1.400
   76    99   469.000  1.400
   82    83   367.000  1.080
   82    87   469.000  1.400
   87    88   367.000  1.080
   87    92   469.000  1.400
   92    93   367.000  1.080
   92    95   469.000  1.400
   95    96   367.000  1.080
   95    99   469.000  1.400
   99   100   367.000  1.080
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    71   268.000  1.529
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    77   268.000  1.529
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    80   340.000  1.090
   44    45   553.000  0.945
   41    42   340.000  1.090
   41    46   317.000  1.510
   41    47   268.000  1.529
   46    51   469.000  1.400
   46    84   469.000  1.400
   51    52   367.000  1.080
   51    66   469.000  1.400
   66    67   367.000  1.080
   66    74   469.000  1.400
   74    75   367.000  1.080
   74    81   469.000  1.400
   81    84   469.000  1.400
   81    86   515.000  1.335
   84    85   367.000  1.080
   86    89   350.000  1.613
   89    90   735.000  1.471
   89    91   735.000  1.471
   89    94   225.000  1.779
   94    97   469.000  1.400
   94   110   485.000  1.342
   97    98   367.000  1.080
   97   101   469.000  1.400
  101   102   367.000  1.080
  101   103   469.000  1.400
  103   104   469.000  1.400
  103   106   317.000  1.510
  104   105   367.000  1.080
  104   110   485.000  1.342
  110   111   475.000  1.020
  106   107   367.000  1.332
  106   108   367.000  1.332
  106   109   367.000  1.332
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    53   268.000  1.529
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   340.000  1.090
   38    39   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    57    75.00000  111.63000
   29    33    38    85.00000  114.68000
   33    37    40    70.00000  124.00000
   33    37    41    65.00000  117.92700
   33    57    50    58.35000  112.70000
   33    57    58    37.50000  110.70000
   33    57    59    37.50000  110.70000
   33    38    39    55.00000  108.50000
   37    40    43    80.00000  120.01400
   37    40    44    80.00000  121.38400
   37    41    42    35.00000  109.50000
   37    41    46    70.00000  112.99600
   37    41    47    70.00000  112.02700
   40    43    50    90.00000  111.18400
   40    44    45    70.00000  107.45700
   43    50    57    50.00000  109.50000
   43    50    60    50.00000  109.50000
   43    50    63    50.00000  109.50000
   50    57    58    37.50000  110.70000
   50    57    59    37.50000  110.70000
   50    60    61    37.50000  110.70000
   50    60    62    37.50000  110.70000
   50    60    68    58.35000  112.70000
   50    63    64    37.50000  110.70000
   50    63    65    37.50000  110.70000
   50    63    71    58.35000  112.70000
   57    33    37    70.00000  112.02700
   59    57    58    33.00000  107.80000
   60    50    57    58.35000  112.70000
   60    68    69    37.50000  110.70000
   60    68    70    37.50000  110.70000
   60    68    76    70.00000  112.17500
   62    60    61    33.00000  107.80000
   68    60    61    37.50000  110.70000
   68    60    62    37.50000  110.70000
   68    76    82    70.00000  120.00000
   68    76    99    70.00000  120.00000
   70    68    69    33.00000  107.80000
   76    68    69    35.00000  109.50000
   76    68    70    35.00000  109.50000
   76    82    83    35.00000  120.00000
   76    82    87    63.00000  120.00000
   76    99    95    63.00000  120.00000
   76    99   100    35.00000  120.00000
   82    87    88    35.00000  120.00000
   82    87    92    63.00000  120.00000
   87    82    83    35.00000  120.00000
   87    92    93    35.00000  120.00000
   87    92    95    63.00000  120.00000
   92    87    88    35.00000  120.00000
   92    95    96    35.00000  120.00000
   92    95    99    63.00000  120.00000
   95    92    93    35.00000  120.00000
   95    99   100    35.00000  120.00000
   99    76    82    63.00000  120.00000
   99    95    96    35.00000  120.00000
   63    50    57    58.35000  112.70000
   63    50    60    58.35000  112.70000
   63    71    72    37.50000  110.70000
   63    71    73    37.50000  110.70000
   63    71    77    58.35000  112.70000
   65    63    64    33.00000  107.80000
   71    63    64    37.50000  110.70000
   71    63    65    37.50000  110.70000
   71    77    78    37.50000  110.70000
   71    77    79    37.50000  110.70000
   71    77    80    37.50000  110.70000
   73    71    72    33.00000  107.80000
   77    71    72    37.50000  110.70000
   77    71    73    37.50000  110.70000
   79    77    78    33.00000  107.80000
   80    77    78    33.00000  107.80000
   80    77    79    33.00000  107.80000
   44    40    43   115.00000  116.36000
   41    37    40    70.00000  124.00000
   41    46    51    70.00000  120.00000
   41    46    84    70.00000  120.00000
   41    47    48    37.50000  110.70000
   41    47    49    37.50000  110.70000
   41    47    53    58.35000  112.70000
   46    41    42    35.00000  109.50000
   46    51    52    35.00000  120.00000
   46    51    66    63.00000  120.00000
   46    84    81    63.00000  120.00000
   46    84    85    35.00000  120.00000
   51    66    67    35.00000  120.00000
   51    66    74    63.00000  120.00000
   66    51    52    35.00000  120.00000
   66    74    75    35.00000  120.00000
   66    74    81    63.00000  120.00000
   74    66    67    35.00000  120.00000
   74    81    84    63.00000  120.00000
   74    81    86    65.00000  124.38400
   81    74    75    35.00000  120.00000
   81    84    85    35.00000  120.00000
   81    86    89    75.00000  122.36500
   84    46    51    63.00000  120.00000
   86    81    84    65.00000  124.38400
   86    89    90   105.00000  114.79700
   86    89    91   105.00000  114.79700
   86    89    94   105.00000   98.50000
   89    94    97    65.00000  117.06700
   89    94   110    80.00000  113.60000
   91    89    90   115.00000  120.17200
   94    89    90   100.00000  107.67100
   94    89    91   100.00000  107.67100
   94    97    98    35.00000  120.00000
   94    97   101    63.00000  120.00000
   94   110   104    70.00000  123.81700
   94   110   111    45.00000  117.56800
   97   101   102    35.00000  120.00000
   97   101   103    63.00000  120.00000
  101    97    98    35.00000  120.00000
  101   103   104    63.00000  120.00000
  101   103   106    70.00000  120.00000
  103   101   102    35.00000  120.00000
  103   104   105    35.00000  120.00000
  103   104   110    70.00000  119.29800
  103   106   107    50.00000  109.50000
  103   106   108    50.00000  109.50000
  103   106   109    50.00000  109.50000
  104   110   111    45.00000  117.56800
  110    94    97    70.00000  119.29800
  110   104   105    45.00000  112.84900
  106   103   104    70.00000  120.00000
  108   106   107    77.00000  109.10000
  109   106   107    77.00000  109.10000
  109   106   108    77.00000  109.10000
   47    41    42    37.50000  110.70000
   47    41    46    70.00000  112.17500
   47    53    54    37.50000  110.70000
   47    53    55    37.50000  110.70000
   47    53    56    37.50000  110.70000
   49    47    48    33.00000  107.80000
   53    47    48    37.50000  110.70000
   53    47    49    37.50000  110.70000
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    33.00000  107.80000
   38    33    37    90.00000  110.39200
   38    33    57    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    57   0.01700  1.0 1.0
   24    29    33    57  -0.23550 -1.0 2.0
   24    29    33    57   0.21350  1.0 3.0
   24    29    33    38   0.13850  1.0 1.0
   24    29    33    38  -1.34450 -1.0 2.0
   24    29    33    38   0.57400  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    40   0.42700  1.0 1.0
   29    33    37    40  -0.70350 -1.0 2.0
   29    33    37    40  -0.43150  1.0 3.0
   29    33    37    41   0.30250  1.0 1.0
   29    33    37    41  -0.14950 -1.0 2.0
   29    33    37    41   0.36900  1.0 3.0
   29    33    57    50   0.44750  1.0 1.0
   29    33    57    50  -0.17800 -1.0 2.0
   29    33    57    50   0.20200  1.0 3.0
   29    33    57    58   0.15000  1.0 3.0
   29    33    57    59   0.15000  1.0 3.0
   29    33    38    39   0.35600  1.0 1.0
   29    33    38    39  -0.10750 -1.0 2.0
   29    33    38    39  -0.54400  1.0 3.0
   33    37    40    43   7.00000 -1.0 2.0
   33    37    40    44   7.00000 -1.0 2.0
   33    37    41    42   0.34800  1.0 3.0
   33    37    41    46   0.09700  1.0 1.0
   33    37    41    46   0.15600 -1.0 2.0
   33    37    41    46  -0.50800  1.0 3.0
   33    37    41    47   0.46850  1.0 1.0
   33    37    41    47   0.08550 -1.0 2.0
   33    37    41    47   0.09800  1.0 3.0
   37    33    57    50   0.34400  1.0 1.0
   37    33    57    50   0.09450 -1.0 2.0
   37    33    57    50   0.11100  1.0 3.0
   37    33    57    58   0.15000  1.0 3.0
   37    33    57    59   0.15000  1.0 3.0
   37    33    38    39  -0.07800  1.0 1.0
   37    33    38    39  -0.21500 -1.0 2.0
   37    33    38    39  -0.03150  1.0 3.0
   37    40   -43    50  -2.26850  1.0 1.0
   37    40   -43    50   3.39050 -1.0 2.0
   37    40    44    45  -0.66100  1.0 1.0
   37    40    44    45   1.20850 -1.0 2.0
   37    40    44    45  -0.36000  1.0 3.0
   37    41    46    51   0.18050 -1.0 2.0
   37    41    46    84   0.18050 -1.0 2.0
   37    41    47    48   0.15000  1.0 3.0
   37    41    47    49   0.15000  1.0 3.0
   37    41    47    53   0.34400  1.0 1.0
   37    41    47    53   0.09450 -1.0 2.0
   37    41    47    53   0.11100  1.0 3.0
   40    37    41    42   0.00000  1.0 1.0
   40    37    41    46   1.44450  1.0 1.0
   40    37    41    46   0.06600 -1.0 2.0
   40    37    41    46   0.29250  1.0 3.0
   40    37    41    47   0.09850  1.0 1.0
   40    37    41    47   0.15250 -1.0 2.0
   40    37    41    47  -0.50650  1.0 3.0
   40    43    50    57  -0.46850  1.0 1.0
   40    43    50    57   0.09300 -1.0 2.0
   40    43    50    57  -0.12850  1.0 3.0
   40    43    50    60  -0.46850  1.0 1.0
   40    43    50    60   0.09300 -1.0 2.0
   40    43    50    60  -0.12850  1.0 3.0
   40    43    50    63  -0.46850  1.0 1.0
   40    43    50    63   0.09300 -1.0 2.0
   40    43    50    63  -0.12850  1.0 3.0
   43    40    44    45   2.00000 -1.0 2.0
   43    50   -57    33   0.62750  1.0 1.0
   43    50   -57    33  -0.30950 -1.0 2.0
   43    50   -57    33   0.27300  1.0 3.0
   43    50    57    58   0.23400  1.0 3.0
   43    50    57    59   0.23400  1.0 3.0
   43    50    60    61   0.23400  1.0 3.0
   43    50    60    62   0.23400  1.0 3.0
   43    50    60    68   0.62750  1.0 1.0
   43    50    60    68  -0.30950 -1.0 2.0
   43    50    60    68   0.27300  1.0 3.0
   43    50    63    64   0.23400  1.0 3.0
   43    50    63    65   0.23400  1.0 3.0
   43    50    63    71   0.62750  1.0 1.0
   43    50    63    71  -0.30950 -1.0 2.0
   43    50    63    71   0.27300  1.0 3.0
   50    60    68    69   0.15000  1.0 3.0
   50    60    68    70   0.15000  1.0 3.0
   50    60    68    76  -0.03700  1.0 1.0
   50    60    68    76   0.37200 -1.0 2.0
   50    60    68    76  -0.47300  1.0 3.0
   50    63    71    72   0.15000  1.0 3.0
   50    63    71    73   0.15000  1.0 3.0
   50    63    71    77   0.56750  1.0 1.0
   50    63    71    77  -0.07550 -1.0 2.0
   50    63    71    77   0.20000  1.0 3.0
   57    33   -37    40   0.09850  1.0 1.0
   57    33   -37    40   0.15250 -1.0 2.0
   57    33   -37    40  -0.50650  1.0 3.0
   57    33    37    41   0.46850  1.0 1.0
   57    33    37    41   0.08550 -1.0 2.0
   57    33    37    41   0.09800  1.0 3.0
   57    33    38    39  -0.11600  1.0 1.0
   57    33    38    39  -0.09450 -1.0 2.0
   57    33    38    39   0.21250  1.0 3.0
   57    50    60    61   0.15000  1.0 3.0
   57    50    60    62   0.15000  1.0 3.0
   57    50    60    68   0.56750  1.0 1.0
   57    50    60    68  -0.07550 -1.0 2.0
   57    50    60    68   0.20000  1.0 3.0
   57    50    63    64   0.15000  1.0 3.0
   57    50    63    65   0.15000  1.0 3.0
   57    50    63    71   0.56750  1.0 1.0
   57    50    63    71  -0.07550 -1.0 2.0
   57    50    63    71   0.20000  1.0 3.0
   60    50    57    33   0.56750  1.0 1.0
   60    50    57    33  -0.07550 -1.0 2.0
   60    50    57    33   0.20000  1.0 3.0
   60    50    57    58   0.15000  1.0 3.0
   60    50    57    59   0.15000  1.0 3.0
   60    50    63    64   0.15000  1.0 3.0
   60    50    63    65   0.15000  1.0 3.0
   60    50    63    71   0.56750  1.0 1.0
   60    50    63    71  -0.07550 -1.0 2.0
   60    50    63    71   0.20000  1.0 3.0
   60    68    76    82   0.04150 -1.0 2.0
   60    68    76    99   0.04150 -1.0 2.0
   61    60    68    69   0.15000  1.0 3.0
   61    60    68    70   0.15000  1.0 3.0
   61    60    68    76   0.43200  1.0 3.0
   62    60    68    69   0.15000  1.0 3.0
   62    60    68    70   0.15000  1.0 3.0
   62    60    68    76   0.43200  1.0 3.0
   68    76    82    83   3.62500 -1.0 2.0
   68    76    82    87   3.62500 -1.0 2.0
   68    76    99    95   3.62500 -1.0 2.0
   68    76    99   100   3.62500 -1.0 2.0
   69    68    76    82   0.00000  1.0 1.0
   69    68    76    99   0.00000  1.0 1.0
   70    68    76    82   0.00000  1.0 1.0
   70    68    76    99   0.00000  1.0 1.0
   76    82    87    88   3.62500 -1.0 2.0
   76    82    87    92   3.62500 -1.0 2.0
   82    76    99    95   3.62500 -1.0 2.0
   82    76    99   100   3.62500 -1.0 2.0
   82    87    92    93   3.62500 -1.0 2.0
   82    87   -92    95   3.62500 -1.0 2.0
   83    82    87    88   3.62500 -1.0 2.0
   83    82    87    92   3.62500 -1.0 2.0
   87    92    95    96   3.62500 -1.0 2.0
   87    92    95    99   3.62500 -1.0 2.0
   88    87    92    93   3.62500 -1.0 2.0
   88    87    92    95   3.62500 -1.0 2.0
   92    95   -99    76   3.62500 -1.0 2.0
   92    95    99   100   3.62500 -1.0 2.0
   93    92    95    96   3.62500 -1.0 2.0
   93    92    95    99   3.62500 -1.0 2.0
   96    95    99    76   3.62500 -1.0 2.0
   96    95    99   100   3.62500 -1.0 2.0
   99    76    82    83   3.62500 -1.0 2.0
   99    76   -82    87   3.62500 -1.0 2.0
   63    50    57    33   0.56750  1.0 1.0
   63    50    57    33  -0.07550 -1.0 2.0
   63    50    57    33   0.20000  1.0 3.0
   63    50    57    58   0.15000  1.0 3.0
   63    50    57    59   0.15000  1.0 3.0
   63    50    60    61   0.15000  1.0 3.0
   63    50    60    62   0.15000  1.0 3.0
   63    50    60    68   0.56750  1.0 1.0
   63    50    60    68  -0.07550 -1.0 2.0
   63    50    60    68   0.20000  1.0 3.0
   63    71    77    78   0.15000  1.0 3.0
   63    71    77    79   0.15000  1.0 3.0
   63    71    77    80   0.15000  1.0 3.0
   64    63    71    72   0.15000  1.0 3.0
   64    63    71    73   0.15000  1.0 3.0
   64    63    71    77   0.15000  1.0 3.0
   65    63    71    72   0.15000  1.0 3.0
   65    63    71    73   0.15000  1.0 3.0
   65    63    71    77   0.15000  1.0 3.0
   72    71    77    78   0.15000  1.0 3.0
   72    71    77    79   0.15000  1.0 3.0
   72    71    77    80   0.15000  1.0 3.0
   73    71    77    78   0.15000  1.0 3.0
   73    71    77    79   0.15000  1.0 3.0
   73    71    77    80   0.15000  1.0 3.0
   44    40    43    50   2.00000 -1.0 2.0
   41    37    40    43   7.00000 -1.0 2.0
   41    37    40    44   7.00000 -1.0 2.0
   41    46    51    52   3.62500 -1.0 2.0
   41    46    51    66   3.62500 -1.0 2.0
   41    46    84    81   3.62500 -1.0 2.0
   41    46    84    85   3.62500 -1.0 2.0
   41    47    53    54   0.15000  1.0 3.0
   41    47    53    55   0.15000  1.0 3.0
   41    47    53    56   0.15000  1.0 3.0
   42    41    46    51   0.00000  1.0 1.0
   42    41    46    84   0.00000  1.0 1.0
   42    41    47    48   0.15000  1.0 3.0
   42    41    47    49   0.15000  1.0 3.0
   42    41    47    53   0.15000  1.0 3.0
   46    41    47    48   0.43200  1.0 3.0
   46    41    47    49   0.43200  1.0 3.0
   46    41    47    53  -0.03700  1.0 1.0
   46    41    47    53   0.37200 -1.0 2.0
   46    41    47    53  -0.47300  1.0 3.0
   46    51    66    67   3.62500 -1.0 2.0
   46    51    66    74   3.62500 -1.0 2.0
   51    46    84    81   3.62500 -1.0 2.0
   51    46    84    85   3.62500 -1.0 2.0
   51    66    74    75   3.62500 -1.0 2.0
   51    66   -74    81   3.62500 -1.0 2.0
   52    51    66    67   3.62500 -1.0 2.0
   52    51    66    74   3.62500 -1.0 2.0
   66    74    81    84   3.62500 -1.0 2.0
   66    74    81    86   3.62500 -1.0 2.0
   67    66    74    75   3.62500 -1.0 2.0
   67    66    74    81   3.62500 -1.0 2.0
   74    81   -84    46   3.62500 -1.0 2.0
   74    81    84    85   3.62500 -1.0 2.0
   74    81    86    89   1.50000 -1.0 2.0
   75    74    81    84   3.62500 -1.0 2.0
   75    74    81    86   3.62500 -1.0 2.0
   81    86    89    90  -0.23550  1.0 1.0
   81    86    89    90   0.77000 -1.0 2.0
   81    86    89    90   0.47650  1.0 3.0
   81    86    89    91  -0.23550  1.0 1.0
   81    86    89    91   0.77000 -1.0 2.0
   81    86    89    91   0.47650  1.0 3.0
   81    86    89    94  -0.64500  1.0 1.0
   81    86    89    94  -1.19050 -1.0 2.0
   81    86    89    94  -0.04400  1.0 3.0
   84    46    51    52   3.62500 -1.0 2.0
   84    46   -51    66   3.62500 -1.0 2.0
   84    81    86    89   1.50000 -1.0 2.0
   86    81    84    46   3.62500 -1.0 2.0
   86    81    84    85   3.62500 -1.0 2.0
   86    89    94    97  -0.49050  1.0 1.0
   86    89    94    97   0.22250 -1.0 2.0
   86    89    94    97  -0.39350  1.0 3.0
   86    89    94   110   0.06400  1.0 1.0
   86    89    94   110  -0.15150 -1.0 2.0
   89    94    97    98   3.62500 -1.0 2.0
   89    94    97   101   3.62500 -1.0 2.0
   89    94   110   104   3.62500 -1.0 2.0
   89    94   110   111   3.62500 -1.0 2.0
   90    89    94    97   0.19500  1.0 1.0
   90    89    94    97   0.12000 -1.0 2.0
   90    89    94   110  -0.11800  1.0 1.0
   90    89    94   110  -0.01100 -1.0 2.0
   90    89    94   110   0.43100  1.0 3.0
   91    89    94    97   0.19500  1.0 1.0
   91    89    94    97   0.12000 -1.0 2.0
   91    89    94   110  -0.11800  1.0 1.0
   91    89    94   110  -0.01100 -1.0 2.0
   91    89    94   110   0.43100  1.0 3.0
   94    97   101   102   3.62500 -1.0 2.0
   94    97   101   103   3.62500 -1.0 2.0
   97    94   110   104   3.62500 -1.0 2.0
   97    94   110   111   3.62500 -1.0 2.0
   97   101  -103   104   3.62500 -1.0 2.0
   97   101   103   106   3.62500 -1.0 2.0
   98    97   101   102   3.62500 -1.0 2.0
   98    97   101   103   3.62500 -1.0 2.0
  101   103   104   105   3.62500 -1.0 2.0
  101   103   104   110   3.62500 -1.0 2.0
  101   103   106   107   0.00000  1.0 1.0
  101   103   106   108   0.00000  1.0 1.0
  101   103   106   109   0.00000  1.0 1.0
  102   101   103   104   3.62500 -1.0 2.0
  102   101   103   106   3.62500 -1.0 2.0
  103   104  -110    94   3.62500 -1.0 2.0
  103   104   110   111   3.62500 -1.0 2.0
  104   103   106   107   0.00000  1.0 1.0
  104   103   106   108   0.00000  1.0 1.0
  104   103   106   109   0.00000  1.0 1.0
  105   104   110    94   3.62500 -1.0 2.0
  105   104   110   111   3.62500 -1.0 2.0
  110    94    97    98   3.62500 -1.0 2.0
  110    94   -97   101   3.62500 -1.0 2.0
  106   103   104   105   3.62500 -1.0 2.0
  106   103   104   110   3.62500 -1.0 2.0
   47    41    46    51   0.04150 -1.0 2.0
   47    41    46    84   0.04150 -1.0 2.0
   48    47    53    54   0.15000  1.0 3.0
   48    47    53    55   0.15000  1.0 3.0
   48    47    53    56   0.15000  1.0 3.0
   49    47    53    54   0.15000  1.0 3.0
   49    47    53    55   0.15000  1.0 3.0
   49    47    53    56   0.15000  1.0 3.0
   38    33    37    40   0.67800  1.0 1.0
   38    33    37    40   0.47050 -1.0 2.0
   38    33    37    40  -0.62500  1.0 3.0
   38    33    37    41   0.18000  1.0 1.0
   38    33    37    41   0.16450 -1.0 2.0
   38    33    37    41   0.04450  1.0 3.0
   38    33    57    50   0.86500  1.0 1.0
   38    33    57    50  -0.17500 -1.0 2.0
   38    33    57    50   0.20800  1.0 3.0
   38    33    57    58   0.23400  1.0 3.0
   38    33    57    59   0.23400  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    41    37    40   1.10000 -1.0 2.0
   43    44    40    37   1.10000 -1.0 2.0
   82    99    76    68   4.00000 -1.0 2.0
   87    83    82    76   1.10000 -1.0 2.0
   92    88    87    82   1.10000 -1.0 2.0
   95    93    92    87   1.10000 -1.0 2.0
   99    96    95    92   1.10000 -1.0 2.0
   95   100    99    76   1.10000 -1.0 2.0
   51    84    46    41   4.00000 -1.0 2.0
   66    52    51    46   1.10000 -1.0 2.0
   74    67    66    51   1.10000 -1.0 2.0
   81    75    74    66   1.10000 -1.0 2.0
   84    86    81    74   4.00000 -1.0 2.0
   81    85    84    46   1.10000 -1.0 2.0
   97   110    94    89   4.00000 -1.0 2.0
  101    98    97    94   1.10000 -1.0 2.0
  103   102   101    97   1.10000 -1.0 2.0
  104   106   103   101   4.00000 -1.0 2.0
  110   105   104   103   1.10000 -1.0 2.0
  111    94   110   104   1.00000 -1.0 2.0
END
