* LIGAND DATABASE FILE (OPLS2005)
*
001     112   115    204    316     586
    1     0 S   NP   _N1_     1    28.72570    96.68591   -15.14303
    2     1 S   H    _HN1     2     1.02833    63.35561   123.31966
    3     1 S   H    _H1_     3     1.02780    58.40847  -101.31315
    4     1 S   H    _H2_     4     1.02955    86.91679    12.42707
    5     1 S   CT   _CA1     5     1.50098   162.58908  -162.66411
    6     5 S   HC   _HA1     6     1.09574   105.26032    -7.43268
    7     5 S   CO3  _C1_     7     1.53849   112.26255  -127.70298
    8     7 S   O2Z  _O11     8     1.26366   115.03509   -46.78994
    9     7 S   O2Z  _O12     9     1.26229   114.93091   132.30427
   10     5 S   CT   _CB1    10     1.53086   107.41234   110.48720
   11    10 S   HC   HB11    11     1.09820   109.51887   -50.25288
   12    10 S   HC   HB12    12     1.09818   110.39813    66.38495
   13    10 S   CT   _CG1    13     1.52930   112.50140  -171.29915
   14    13 S   HC   HG11    14     1.09589   110.37830   -60.73799
   15    13 S   HC   HG12    15     1.09651   110.07121    58.38999
   16    13 S   C    _CD1    16     1.51795   112.32435   178.81238
   17    16 S   O    _OE1    17     1.22708   123.37769    -5.77295
   18    16 S   N    _N2_    18     1.38491   111.43524   174.43451
   19    18 S   H    _HN2    19     1.01579   118.93613     1.79144
   20    18 S   CT1  _CA2    20     1.46205   123.78345  -178.15963
   21    20 S   HC   _HA2    21     1.09720   109.42547    -8.78163
   22    20 S   C    _C2_    22     1.53479   108.97101  -124.50356
   23    22 S   O    _O2_    23     1.23032   122.29201  -152.92116
   24    20 S   CT   _CB2    32     1.53377   110.61191   113.31121
   25    24 S   HC   HB21    33     1.09264   108.63035    51.76519
   26    24 S   HC   HB22    34     1.09463   110.63141   170.49564
   27    22 S   N    _N3_    24     1.38313   113.51285    34.81777
   28    27 S   H    _HN3    25     1.01609   119.23814    -3.61872
   29    24 S   S    _SG2    35     1.83462   111.05333   -70.20866
   30    27 S   CT   _CA3    26     1.45256   123.51903   175.70181
   31    30 S   HC   HA31    27     1.09530   107.04444   -80.57784
   32    30 S   HC   HA32    28     1.09467   108.76783    35.92230
   33    29 S   CT   _C24    36     1.86413   102.72074   157.82742
   34    30 S   CO3  _C3_    29     1.52953   113.88993   159.03009
   35    34 S   O2Z  _O31    30     1.26365   116.07177     8.01883
   36    34 S   O2Z  _O32    31     1.26415   114.44735  -172.05876
   37    33 S   CM   _C21    37     1.51524   109.98321    44.25356
   38    33 S   CT   _C25   109     1.53801   106.35008   168.01987
   39    38 S   HC   _H14   110     1.09661   111.26434    66.55836
   40    38 S   HC   _H15   111     1.09639   112.53178   -54.43424
   41    38 S   HC   _H16   112     1.09700   111.08707  -174.14666
   42    37 S   NI   _N7_    38     1.37781   111.39861  -105.55690
   43    37 S   CM   _C20    48     1.34596   124.96717    75.11032
   44    43 S   HC   _H13    49     1.08342   121.04932     1.00054
   45    42 S   CD   _C22    39     1.30366   110.42570   -10.40342
   46    45 S   OM   _O34    40     1.24776   127.76341  -179.38261
   47    43 S   CD   _C19    50     1.47929   121.52266  -175.84461
   48    33 S   CT   _C23    41     1.54938   116.16329   -69.56776
   49    48 S   HC   _H4_    42     1.10259   109.19446  -147.96429
   50    47 S   CM   _C18    51     1.47293   120.16659  -156.32158
   51    48 S   CM   _C26    43     1.50728   117.36644   -24.04950
   52    51 S   HC   _H17    44     1.08643   118.01013    72.85849
   53    50 S   CM   _C17    52     1.34401   101.53715  -178.15910
   54    50 S   CT   _C28   105     1.47913   126.22869     2.05976
   55    54 S   HC   _H20   106     1.09455   110.53702   -61.07297
   56    54 S   HC   _H21   107     1.09344   112.22572   179.19692
   57    54 S   HC   _H22   108     1.09452   110.52622    59.05264
   58    51 S   CM   _C27    45     1.33846   123.97720  -108.82071
   59    58 S   HC   _H18    46     1.08517   120.44700  -179.19109
   60    58 S   HC   _H19    47     1.08425   121.59760     0.87447
   61    53 S   CM   _C16    53     1.45702   110.02089    -0.09691
   62    53 S   CT   _C29    96     1.50064   126.28800  -178.64896
   63    62 S   HC   _H23    97     1.09699   109.84703    23.03990
   64    62 S   HC   _H24    98     1.09710   110.13344   137.93692
   65    47 S   NI   _N6_    54     1.29795   125.26141    26.61790
   66    61 S   CM   _C15    55     1.34575   127.72216  -178.68582
   67    66 S   HC   _H12    56     1.08633   119.08822    -0.28324
   68    62 S   CT   _C30    99     1.52688   112.13447   -98.57141
   69    68 S   HC   _H25   100     1.09700   110.14785   -62.23070
   70    68 S   HC   _H26   101     1.09786   109.61394    55.40500
   71    66 S   C5A  _C14    57     1.42902   124.81106   179.01245
   72    68 S   CO3  _C31   102     1.53192   114.77774   176.40114
   73    72 S   O2Z  _O36   103     1.26517   114.04570  -174.96386
   74    72 S   O2Z  _O35   104     1.26134   116.67267     4.95970
   75    71 S   C5BC _C13    58     1.39005   132.80763  -174.98737
   76    75 S   C5BC _C12    59     1.44271   107.51679   179.69545
   77    75 S   CT   _C32    87     1.50113   126.54374     0.20367
   78    77 S   HC   _H27    88     1.09714   109.74483    29.19642
   79    77 S   HC   _H28    89     1.09679   109.37919   144.55222
   80    76 S   C5A  _C11    60     1.38626   107.04725     1.86907
   81    76 S   CT   _C35    83     1.48954   125.71640  -177.63396
   82    81 S   HC   _H31    84     1.09451   110.76888    44.80501
   83    81 S   HC   _H32    85     1.09419   111.76943   164.09164
   84    81 S   HC   _H33    86     1.09442   110.31268   -75.20233
   85    77 S   CT   _C33    90     1.52550   112.17311   -93.19864
   86    85 S   HC   _H29    91     1.09761   109.71355    61.14213
   87    85 S   HC   _H30    92     1.09766   109.79685   -56.00598
   88    71 S   NA   _N5_    61     1.37471   120.53977     4.72530
   89    88 S   H    _H11    62     1.01258   124.09306    -0.39958
   90    80 S   CM   _C10    63     1.41903   136.65163   179.28072
   91    90 S   HC   _H10    64     1.08760   116.22881   130.85853
   92    85 S   CO3  _C34    93     1.53111   114.87700  -177.31045
   93    92 S   O2Z  _O38    94     1.26524   114.06608   177.61649
   94    92 S   O2Z  _O37    95     1.26138   116.68436    -2.22669
   95    90 S   CM   _C9_    65     1.34249   124.09858   -51.03245
   96    95 S   CM   _C6_    66     1.45854   127.45360   179.93744
   97    96 S   CT   _C7_    67     1.51932   107.66985  -169.76630
   98    97 S   HC   _H3_    68     1.09385   111.48131  -127.43154
   99    96 S   CM   _C5_    77     1.34502   126.30331    15.44237
  100    99 S   HC   _H8_    78     1.08778   119.70977    -2.98295
  101    97 S   C    _C8_    69     1.51866   102.06619   -11.88707
  102   101 S   O    _O33    70     1.22217   125.56223  -173.21470
  103    97 S   CT   _C36    73     1.52363   113.18735   105.82809
  104   103 S   HC   _H34    74     1.09635   111.70955   -56.68710
  105   103 S   HC   _H35    75     1.09560   110.51700  -175.92956
  106   103 S   HC   _H36    76     1.09443   111.45963    64.14188
  107    99 S   CT   _C4_    79     1.49554   126.20833   175.88720
  108   107 S   HC   _H5_    80     1.09406   109.71764  -123.10666
  109   107 S   HC   _H6_    81     1.09425   109.73894   118.20840
  110   107 S   HC   _H7_    82     1.09256   113.33798    -2.80198
  111    95 S   N    _N4_    71     1.36624   125.27336    -0.67144
  112   111 S   H    _H9_    72     1.01244   123.29704    -4.80946
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  12   5   4   3
  16   2   1   1  15   9   3   2   1   8   9   3   6   3  10   6
   3  12   4   3  16   6   2   1   1   2   1   1  10  10   5   4
   3   8   3   5   4   3  11   2   1   1  16  14  11   5   4  11
   5   2   1   1   5   4   3   4   1   8   3   2   1   1  11  16
  12   8   8   4   7   3   4   2   1   1   3   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    48    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    42    45    48    49    51    43    38    39    40    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    42    45    46    48    49    51    52    58    43    44    47    38    39    40    41  
   35    36  
   36  
    0  
   42    45    46    48    49    51    43    44    47    50    65    38    39    40    41  
   39    40    41    42    43    45    48    49    51  
   40    41    48  
   41    48  
   48  
   45    46    48    49    51    43    44    47  
   44    47    50    53    61    65    54    45    48  
   47    50    65  
   46    48    49    51    52    58  
   48    49    51  
   50    53    61    65    66    62    54    55    56    57  
   49    51    52    58    59    60  
   51    52    58  
   53    61    65    66    62    63    64    68    54    55    56    57  
   52    58    59    60  
   58    59    60  
   61    65    66    67    71    62    63    64    68    69    70    72    54    55    56    57  
   55    56    57    61    62    65  
   56    57  
   57  
    0  
   59    60  
   60  
    0  
   65    66    67    71    75    88    62    63    64    68  
   63    64    68    69    70    72    73    74    65    66  
   64    68    69    70    72  
   68    69    70    72  
   66    67    71  
   67    71    75    76    80    88    89    77  
   71    75    88  
   69    70    72    73    74  
   70    72    73    74  
   72    73    74  
   75    76    80    88    89    90    81    77    78    79    85  
   73    74  
   74  
    0  
   76    80    88    89    90    81    82    83    84    77    78    79    85    86    87    92  
   80    88    89    90    91    95    81    82    83    84    77    78    79    85  
   78    79    85    86    87    92    93    94    80    81    88  
   79    85    86    87    92  
   85    86    87    92  
   88    89    90    91    95    96   111    81    82    83    84  
   82    83    84    88    90  
   83    84  
   84  
    0  
   86    87    92    93    94  
   87    92    93    94  
   92    93    94  
   89    90    91    95  
   90  
   91    95    96    97   101   111   112    99  
   95    96   111  
   93    94  
   94  
    0  
   96    97    98   101   102   111   112   103    99   100   107  
   97    98   101   102   111   112   103   104   105   106    99   100   107   108   109   110  
   98   101   102   111   112   103   104   105   106    99   100   107  
  101   102   111   103   104   105   106    99  
  100   107   108   109   110   101   103   111  
  107   108   109   110  
  102   111   112   103   104   105   106  
  111   112   103  
  104   105   106   111  
  105   106  
  106  
    0  
  108   109   110  
  109   110  
  110  
    0  
  112  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760   0.122500   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.2800   0.1700  -0.912200   1.8540   1.6400   0.005000000   0.000000000
   43   3.5500   0.0760  -0.118300   2.0020   1.7750   0.023028004  -0.852763146
   44   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   45   3.7500   0.1050   0.438600   2.0020   1.7750   0.023028004  -0.852763146
   46   3.1500   0.2500  -0.685000   1.7825   1.5750   0.001000000  -0.126889456
   47   3.7500   0.1050   0.396300   2.0020   1.7750   0.023028004  -0.852763146
   48   3.5000   0.0660  -0.023900   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0760  -0.003300   2.0020   1.7750   0.023028004  -0.852763146
   51   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   52   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   54   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   59   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   60   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5500   0.0760   0.122500   2.0020   1.7750   0.023028004  -0.852763146
   62   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.2800   0.1700  -0.512200   1.8540   1.6400   0.005000000   0.000000000
   66   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   67   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   71   3.5500   0.0700  -0.008000   2.0020   1.7750   0.001000000  -0.843144165
   72   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   73   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   74   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   75   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   76   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   77   3.5000   0.0660  -0.005000   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   3.5500   0.0700  -0.008000   2.0020   1.7750   0.001000000  -0.843144165
   81   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   87   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   88   3.2500   0.1700  -0.239000   1.8650   1.6500   0.001000000  -0.511443539
   89   0.5000   0.0300   0.317000   0.9960   0.8600   0.030040813  -0.651083722
   90   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   91   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   92   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   93   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   94   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   95   3.5500   0.0760   0.051300   2.0020   1.7750   0.023028004  -0.852763146
   96   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   97   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
  100   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  101   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
  102   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
  103   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  108   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  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   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
  112   0.5000   0.0300   0.300000   1.5900   1.4000   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    48   268.000  1.529
   33    38   268.000  1.529
   37    42   405.000  1.380
   37    43   549.000  1.340
   42    45   500.000  1.261
   45    46   795.000  1.237
   45    48   270.000  1.508
   48    49   340.000  1.090
   48    51   317.000  1.510
   51    52   340.000  1.080
   51    58   549.000  1.340
   58    59   340.000  1.080
   58    60   340.000  1.080
   43    44   340.000  1.080
   43    47   320.000  1.464
   47    50   320.000  1.464
   47    65   500.000  1.261
   50    53   549.000  1.340
   50    54   317.000  1.510
   53    61   380.000  1.444
   53    62   317.000  1.510
   61    65   405.000  1.380
   61    66   549.000  1.340
   66    67   340.000  1.080
   66    71   375.000  1.423
   71    75   546.000  1.367
   71    88   427.000  1.381
   75    76   469.000  1.424
   75    77   285.000  1.502
   76    80   546.000  1.367
   76    81   285.000  1.502
   80    88   427.000  1.381
   80    90   375.000  1.423
   88    89   434.000  1.010
   90    91   340.000  1.080
   90    95   549.000  1.340
   95    96   380.000  1.444
   95   111   400.000  1.384
   96    97   317.000  1.510
   96    99   549.000  1.340
   97    98   340.000  1.090
   97   101   317.000  1.522
   97   103   268.000  1.529
  101   102   570.000  1.229
  101   111   490.000  1.335
  111   112   434.000  1.010
  103   104   340.000  1.090
  103   105   340.000  1.090
  103   106   340.000  1.090
   99   100   340.000  1.080
   99   107   317.000  1.510
  107   108   340.000  1.090
  107   109   340.000  1.090
  107   110   340.000  1.090
   81    82   340.000  1.090
   81    83   340.000  1.090
   81    84   340.000  1.090
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    85   268.000  1.529
   85    86   340.000  1.090
   85    87   340.000  1.090
   85    92   317.000  1.522
   92    93   656.000  1.250
   92    94   656.000  1.250
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    68   268.000  1.529
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    72   317.000  1.522
   72    73   656.000  1.250
   72    74   656.000  1.250
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   340.000  1.090
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   340.000  1.090
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    48    75.00000  111.63000
   29    33    38    75.00000  111.63000
   33    37    42    65.00000  119.96000
   33    37    43    70.00000  124.00000
   33    48    45    70.00000  111.76100
   33    48    49    37.50000  110.70000
   33    48    51    70.00000  112.02700
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    37.50000  110.70000
   37    42    45    75.00000  115.77100
   37    43    44    35.00000  120.00000
   37    43    47    60.00000  120.31500
   42    45    46    75.00000  134.47000
   42    45    48    65.00000  122.10100
   45    48    49    45.00000  109.49600
   45    48    51    70.00000  110.51600
   48    33    37    70.00000  112.02700
   48    45    46    75.00000  122.80800
   48    51    52    35.00000  117.00000
   48    51    58    70.00000  124.00000
   51    48    49    35.00000  109.50000
   51    58    59    35.00000  120.00000
   51    58    60    35.00000  120.00000
   58    51    52    35.00000  120.00000
   60    58    59    35.00000  117.00000
   43    37    42    70.00000  120.83400
   43    47    50    65.00000  123.36000
   43    47    65    70.00000  121.86000
   47    43    44    40.00000  114.85300
   47    50    53    60.00000  120.31500
   47    50    54    65.00000  117.22000
   47    65    61    75.00000  115.77100
   50    53    61    70.00000  123.01800
   50    53    62    70.00000  124.00000
   50    54    55    35.00000  109.50000
   50    54    56    35.00000  109.50000
   50    54    57    35.00000  109.50000
   53    61    65    70.00000  120.83400
   53    61    66    70.00000  123.01800
   53    62    63    35.00000  109.50000
   53    62    64    35.00000  109.50000
   53    62    68    70.00000  112.02700
   61    66    67    35.00000  120.00000
   61    66    71    55.00000  128.24000
   65    47    50    70.00000  121.86000
   66    61    65    70.00000  120.83400
   66    71    75    50.00000  133.16000
   66    71    88    70.00000  120.38000
   71    66    67    40.00000  117.26300
   71    75    76    70.00000  107.30000
   71    75    77    60.00000  130.00000
   71    88    80    70.00000  109.80000
   71    88    89    35.00000  120.00000
   75    76    80    70.00000  107.30000
   75    76    81    60.00000  130.00000
   75    77    78    35.00000  109.50000
   75    77    79    35.00000  109.50000
   75    77    85    70.00000  112.17500
   76    80    88    70.00000  107.70000
   76    80    90    50.00000  133.16000
   76    81    82    35.00000  109.50000
   76    81    83    35.00000  109.50000
   76    81    84    35.00000  109.50000
   80    88    89    35.00000  120.00000
   80    90    91    40.00000  117.26300
   80    90    95    55.00000  128.24000
   88    71    75    70.00000  107.70000
   90    80    88    70.00000  120.38000
   90    95    96    70.00000  123.01800
   90    95   111    75.00000  120.83300
   95    90    91    35.00000  120.00000
   95    96    97    70.00000  124.00000
   95    96    99    70.00000  123.01800
   95   111   101    70.00000  120.89900
   95   111   112    45.00000  117.55000
   96    97    98    35.00000  109.50000
   96    97   101    70.00000  115.00700
   96    97   103    70.00000  112.02700
   96    99   100    35.00000  120.00000
   96    99   107    70.00000  124.00000
   97   101   102    80.00000  120.40000
   97   101   111    70.00000  116.60000
   97   103   104    37.50000  110.70000
   97   103   105    37.50000  110.70000
   97   103   106    37.50000  110.70000
  101    97    98    35.00000  109.50000
  101   111   112    35.00000  119.80000
  111    95    96    75.00000  120.83300
  111   101   102    80.00000  122.90000
  103    97    98    37.50000  110.70000
  103    97   101    63.00000  111.10000
  105   103   104    33.00000  107.80000
  106   103   104    33.00000  107.80000
  106   103   105    33.00000  107.80000
   99    96    97    70.00000  124.00000
   99   107   108    35.00000  109.50000
   99   107   109    35.00000  109.50000
   99   107   110    35.00000  109.50000
  107    99   100    35.00000  117.00000
  109   107   108    33.00000  107.80000
  110   107   108    33.00000  107.80000
  110   107   109    33.00000  107.80000
   81    76    80    60.00000  130.00000
   83    81    82    33.00000  107.80000
   84    81    82    33.00000  107.80000
   84    81    83    33.00000  107.80000
   77    75    76    60.00000  130.00000
   77    85    86    37.50000  110.70000
   77    85    87    37.50000  110.70000
   77    85    92    70.00000  109.69300
   79    77    78    33.00000  107.80000
   85    77    78    37.50000  110.70000
   85    77    79    37.50000  110.70000
   85    92    93    70.00000  117.00000
   85    92    94    70.00000  117.00000
   87    85    86    33.00000  107.80000
   92    85    86    35.00000  109.50000
   92    85    87    35.00000  109.50000
   94    92    93    80.00000  126.00000
   62    53    61    70.00000  124.00000
   62    68    69    37.50000  110.70000
   62    68    70    37.50000  110.70000
   62    68    72    70.00000  109.69300
   64    62    63    33.00000  107.80000
   68    62    63    37.50000  110.70000
   68    62    64    37.50000  110.70000
   68    72    73    70.00000  117.00000
   68    72    74    70.00000  117.00000
   70    68    69    33.00000  107.80000
   72    68    69    35.00000  109.50000
   72    68    70    35.00000  109.50000
   74    72    73    80.00000  126.00000
   54    50    53    70.00000  124.00000
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    33.00000  107.80000
   38    33    37    70.00000  112.02700
   38    33    48    58.35000  112.70000
   40    38    39    33.00000  107.80000
   41    38    39    33.00000  107.80000
   41    38    40    33.00000  107.80000
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    48   0.01700  1.0 1.0
   24    29    33    48  -0.23550 -1.0 2.0
   24    29    33    48   0.21350  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
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    42   0.09700  1.0 1.0
   29    33    37    42   0.15600 -1.0 2.0
   29    33    37    42  -0.50800  1.0 3.0
   29    33    37    43   0.42700  1.0 1.0
   29    33    37    43  -0.70350 -1.0 2.0
   29    33    37    43  -0.43150  1.0 3.0
   29    33    48    45   0.56750  1.0 1.0
   29    33    48    45  -0.07550 -1.0 2.0
   29    33    48    45   0.20000  1.0 3.0
   29    33    48    49   0.15000  1.0 3.0
   29    33    48    51   0.56750  1.0 1.0
   29    33    48    51  -0.07550 -1.0 2.0
   29    33    48    51   0.20000  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.15000  1.0 3.0
   33    37   -42    45   1.00000 -1.0 2.0
   33    37    43    44   7.00000 -1.0 2.0
   33    37    43    47   7.00000 -1.0 2.0
   33    48    51    52   0.00000  1.0 1.0
   33    48    51    58   0.09850  1.0 1.0
   33    48    51    58   0.15250 -1.0 2.0
   33    48    51    58  -0.50650  1.0 3.0
   37    33   -48    45   0.31000  1.0 1.0
   37    33   -48    45   0.14700 -1.0 2.0
   37    33   -48    45   0.07550  1.0 3.0
   37    33    48    49   0.15000  1.0 3.0
   37    33    48    51   0.31000  1.0 1.0
   37    33    48    51   0.14700 -1.0 2.0
   37    33    48    51   0.07550  1.0 3.0
   37    33    38    39   0.15000  1.0 3.0
   37    33    38    40   0.15000  1.0 3.0
   37    33    38    41   0.15000  1.0 3.0
   37    42    45    46   6.00000 -1.0 2.0
   37    42   -45    48   6.00000 -1.0 2.0
   37    43    47    50   0.69550 -1.0 2.0
   37    43    47    65   1.09650  1.0 1.0
   37    43    47    65   0.48950 -1.0 2.0
   37    43    47    65   0.49400  1.0 3.0
   42    37    43    44   7.00000 -1.0 2.0
   42    37    43    47   7.00000 -1.0 2.0
   42    45   -48    33   0.00000  1.0 1.0
   42    45    48    49   0.00000  1.0 1.0
   42    45    48    51   0.00000  1.0 1.0
   45    48    51    52   0.00000  1.0 1.0
   45    48    51    58  -0.28300  1.0 1.0
   45    48    51    58   0.26700 -1.0 2.0
   45    48    51    58  -0.63300  1.0 3.0
   46    45    48    33   0.00000  1.0 1.0
   46    45    48    49   0.00000  1.0 1.0
   46    45    48    51   0.00000  1.0 1.0
   48    33   -37    42   0.09700  1.0 1.0
   48    33   -37    42   0.15600 -1.0 2.0
   48    33   -37    42  -0.50800  1.0 3.0
   48    33    37    43   0.09850  1.0 1.0
   48    33    37    43   0.15250 -1.0 2.0
   48    33    37    43  -0.50650  1.0 3.0
   48    33    38    39   0.15000  1.0 3.0
   48    33    38    40   0.15000  1.0 3.0
   48    33    38    41   0.15000  1.0 3.0
   48    51    58    59   7.00000 -1.0 2.0
   48    51    58    60   7.00000 -1.0 2.0
   49    48    51    52   0.33100  1.0 3.0
   49    48    51    58   0.00000  1.0 1.0
   52    51    58    59   7.00000 -1.0 2.0
   52    51    58    60   7.00000 -1.0 2.0
   43    37    42    45   1.00000 -1.0 2.0
   43    47    50    53   0.69550 -1.0 2.0
   43    47    50    54   7.00000 -1.0 2.0
   43    47    65    61   6.00000 -1.0 2.0
   44    43    47    50   0.00000  1.0 1.0
   44    43    47    65   1.00600 -1.0 2.0
   47    50   -53    61   7.00000 -1.0 2.0
   47    50    53    62   7.00000 -1.0 2.0
   47    50    54    55   0.00000  1.0 1.0
   47    50    54    56   0.00000  1.0 1.0
   47    50    54    57   0.00000  1.0 1.0
   50    47   -65    61   6.00000 -1.0 2.0
   50    53   -61    65  -0.18600  1.0 3.0
   50    53    61    66   0.28850  1.0 1.0
   50    53    61    66   2.61350 -1.0 2.0
   50    53    61    66   0.78400  1.0 3.0
   50    53    62    63   0.00000  1.0 1.0
   50    53    62    64   0.00000  1.0 1.0
   50    53    62    68   0.09850  1.0 1.0
   50    53    62    68   0.15250 -1.0 2.0
   50    53    62    68  -0.50650  1.0 3.0
   53    50    54    55   0.00000  1.0 1.0
   53    50    54    56   0.00000  1.0 1.0
   53    50    54    57   0.00000  1.0 1.0
   53    61   -65    47   1.00000 -1.0 2.0
   53    61    66    67   7.00000 -1.0 2.0
   53    61    66    71   7.00000 -1.0 2.0
   53    62    68    69   0.15000  1.0 3.0
   53    62    68    70   0.15000  1.0 3.0
   53    62    68    72  -0.98800  1.0 1.0
   53    62    68    72   0.48800 -1.0 2.0
   53    62    68    72   0.76800  1.0 3.0
   61    53    62    63   0.00000  1.0 1.0
   61    53    62    64   0.00000  1.0 1.0
   61    53    62    68   0.98200  1.0 1.0
   61    53    62    68  -0.11900 -1.0 2.0
   61    53    62    68   0.24250  1.0 3.0
   61    66    71    75   0.15800  1.0 1.0
   61    66    71    75   1.85350 -1.0 2.0
   61    66    71    75  -0.48700  1.0 3.0
   61    66    71    88   0.11450  1.0 1.0
   61    66    71    88   1.85100 -1.0 2.0
   61    66    71    88  -0.49050  1.0 3.0
   65    47   -50    53   1.09650  1.0 1.0
   65    47   -50    53   0.48950 -1.0 2.0
   65    47   -50    53   0.49400  1.0 3.0
   65    47    50    54   7.00000 -1.0 2.0
   65    61    66    67   7.00000 -1.0 2.0
   65    61    66    71   7.00000 -1.0 2.0
   66    61    65    47   1.00000 -1.0 2.0
   66    71    75    76   3.62500 -1.0 2.0
   66    71    75    77   3.62500 -1.0 2.0
   66    71    88    80   3.62500 -1.0 2.0
   66    71    88    89   2.00000 -1.0 2.0
   67    66    71    75   0.56550  1.0 3.0
   67    66    71    88   0.54250  1.0 3.0
   71    75   -76    80   3.62500 -1.0 2.0
   71    75    76    81   3.62500 -1.0 2.0
   71    75    77    78   0.00000  1.0 1.0
   71    75    77    79   0.00000  1.0 1.0
   71    75    77    85   0.04150 -1.0 2.0
   75    71   -88    80   3.62500 -1.0 2.0
   75    71    88    89   2.00000 -1.0 2.0
   75    76   -80    88   3.62500 -1.0 2.0
   75    76    80    90   3.62500 -1.0 2.0
   75    76    81    82   0.00000  1.0 1.0
   75    76    81    83   0.00000  1.0 1.0
   75    76    81    84   0.00000  1.0 1.0
   75    77    85    86   0.43200  1.0 3.0
   75    77    85    87   0.43200  1.0 3.0
   75    77    85    92  -2.95950  1.0 1.0
   75    77    85    92   0.02300  1.0 3.0
   76    75    77    78   0.00000  1.0 1.0
   76    75    77    79   0.00000  1.0 1.0
   76    75    77    85   0.04150 -1.0 2.0
   76    80   -88    71   3.62500 -1.0 2.0
   76    80    88    89   2.00000 -1.0 2.0
   76    80    90    91   0.56550  1.0 3.0
   76    80    90    95   0.15800  1.0 1.0
   76    80    90    95   1.85350 -1.0 2.0
   76    80    90    95  -0.48700  1.0 3.0
   80    76    81    82   0.00000  1.0 1.0
   80    76    81    83   0.00000  1.0 1.0
   80    76    81    84   0.00000  1.0 1.0
   80    90    95    96   7.00000 -1.0 2.0
   80    90    95   111   7.00000 -1.0 2.0
   88    71   -75    76   3.62500 -1.0 2.0
   88    71    75    77   3.62500 -1.0 2.0
   88    80    90    91   0.54250  1.0 3.0
   88    80    90    95   0.11450  1.0 1.0
   88    80    90    95   1.85100 -1.0 2.0
   88    80    90    95  -0.49050  1.0 3.0
   90    80    88    71   3.62500 -1.0 2.0
   90    80    88    89   2.00000 -1.0 2.0
   90    95    96    97  -0.18600  1.0 3.0
   90    95    96    99   0.28850  1.0 1.0
   90    95    96    99   2.61350 -1.0 2.0
   90    95    96    99   0.78400  1.0 3.0
   90    95   111   101  -0.18900  1.0 1.0
   90    95   111   101   1.70900 -1.0 2.0
   90    95   111   112   0.78350 -1.0 2.0
   91    90    95    96   7.00000 -1.0 2.0
   91    90    95   111   7.00000 -1.0 2.0
   95    96    97    98   0.00000  1.0 1.0
   95    96   -97   101  -0.51250  1.0 1.0
   95    96   -97   101  -0.88800 -1.0 2.0
   95    96   -97   101   0.08850  1.0 3.0
   95    96    97   103   0.98200  1.0 1.0
   95    96    97   103  -0.11900 -1.0 2.0
   95    96    97   103   0.24250  1.0 3.0
   95    96    99   100   7.00000 -1.0 2.0
   95    96    99   107   7.00000 -1.0 2.0
   96    95  -111   101  -0.18900  1.0 1.0
   96    95  -111   101   1.70900 -1.0 2.0
   96    95   111   112   0.78350 -1.0 2.0
   96    97   101   102   0.30150 -1.0 2.0
   96    97  -101   111   0.00000  1.0 1.0
   96    97   103   104   0.15000  1.0 3.0
   96    97   103   105   0.15000  1.0 3.0
   96    97   103   106   0.15000  1.0 3.0
   96    99   107   108   0.00000  1.0 1.0
   96    99   107   109   0.00000  1.0 1.0
   96    99   107   110   0.00000  1.0 1.0
   97    96    99   100   7.00000 -1.0 2.0
   97    96    99   107   7.00000 -1.0 2.0
   97   101  -111    95   0.67100  1.0 1.0
   97   101  -111    95   1.42150 -1.0 2.0
   97   101  -111    95   0.18700  1.0 3.0
   97   101   111   112   2.45000 -1.0 2.0
   98    97   101   102   0.00000  1.0 1.0
   98    97   101   111   0.00000  1.0 1.0
   98    97   103   104   0.15000  1.0 3.0
   98    97   103   105   0.15000  1.0 3.0
   98    97   103   106   0.15000  1.0 3.0
  101    97   103   104  -0.11250  1.0 3.0
  101    97   103   105  -0.11250  1.0 3.0
  101    97   103   106  -0.11250  1.0 3.0
  102   101   111    95   2.67200 -1.0 2.0
  102   101   111   112   2.45000 -1.0 2.0
  111    95   -96    97   1.08500 -1.0 2.0
  111    95    96    99  -0.18600  1.0 3.0
  103    97   101   102   0.30150 -1.0 2.0
  103    97   101   111   1.39750  1.0 1.0
  103    97   101   111  -0.07950 -1.0 2.0
  103    97   101   111  -0.18750  1.0 3.0
   99    96    97    98   0.00000  1.0 1.0
   99    96    97   101  -0.51250  1.0 1.0
   99    96    97   101  -0.88800 -1.0 2.0
   99    96    97   101   0.08850  1.0 3.0
   99    96    97   103   0.09850  1.0 1.0
   99    96    97   103   0.15250 -1.0 2.0
   99    96    97   103  -0.50650  1.0 3.0
  100    99   107   108   0.33100  1.0 3.0
  100    99   107   109   0.33100  1.0 3.0
  100    99   107   110   0.33100  1.0 3.0
   81    76    80    88   3.62500 -1.0 2.0
   81    76    80    90   3.62500 -1.0 2.0
   77    75    76    80   3.62500 -1.0 2.0
   77    75    76    81   3.62500 -1.0 2.0
   77    85    92    93   0.41150 -1.0 2.0
   77    85    92    94   0.41150 -1.0 2.0
   78    77    85    86   0.15000  1.0 3.0
   78    77    85    87   0.15000  1.0 3.0
   78    77    85    92  -0.11250  1.0 3.0
   79    77    85    86   0.15000  1.0 3.0
   79    77    85    87   0.15000  1.0 3.0
   79    77    85    92  -0.11250  1.0 3.0
   86    85    92    93   0.00000  1.0 1.0
   86    85    92    94   0.00000  1.0 1.0
   87    85    92    93   0.00000  1.0 1.0
   87    85    92    94   0.00000  1.0 1.0
   62    53    61    65   1.08500 -1.0 2.0
   62    53    61    66  -0.18600  1.0 3.0
   62    68    72    73   0.41150 -1.0 2.0
   62    68    72    74   0.41150 -1.0 2.0
   63    62    68    69   0.15000  1.0 3.0
   63    62    68    70   0.15000  1.0 3.0
   63    62    68    72  -0.11250  1.0 3.0
   64    62    68    69   0.15000  1.0 3.0
   64    62    68    70   0.15000  1.0 3.0
   64    62    68    72  -0.11250  1.0 3.0
   69    68    72    73   0.00000  1.0 1.0
   69    68    72    74   0.00000  1.0 1.0
   70    68    72    73   0.00000  1.0 1.0
   70    68    72    74   0.00000  1.0 1.0
   54    50    53    61   7.00000 -1.0 2.0
   54    50    53    62   7.00000 -1.0 2.0
   38    33    37    42   0.09700  1.0 1.0
   38    33    37    42   0.15600 -1.0 2.0
   38    33    37    42  -0.50800  1.0 3.0
   38    33    37    43   0.09850  1.0 1.0
   38    33    37    43   0.15250 -1.0 2.0
   38    33    37    43  -0.50650  1.0 3.0
   38    33    48    45   0.34400  1.0 1.0
   38    33    48    45   0.09450 -1.0 2.0
   38    33    48    45   0.11100  1.0 3.0
   38    33    48    49   0.15000  1.0 3.0
   38    33    48    51   0.34400  1.0 1.0
   38    33    48    51   0.09450 -1.0 2.0
   38    33    48    51   0.11100  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    42    37    43   1.10000 -1.0 2.0
   48    46    45    42  10.50000 -1.0 2.0
   48    52    51    58  15.00000 -1.0 2.0
   59    60    58    51  15.00000 -1.0 2.0
   47    44    43    37   1.10000 -1.0 2.0
   43    50    47    65  10.50000 -1.0 2.0
   47    54    50    53   1.10000 -1.0 2.0
   61    62    53    50   1.10000 -1.0 2.0
   53    65    61    66   1.10000 -1.0 2.0
   71    67    66    61   1.10000 -1.0 2.0
   75    88    71    66   4.00000 -1.0 2.0
   76    77    75    71   4.00000 -1.0 2.0
   80    81    76    75   4.00000 -1.0 2.0
   90    88    80    76   4.00000 -1.0 2.0
   89    71    88    80   1.00000 -1.0 2.0
   80    91    90    95   1.10000 -1.0 2.0
   96   111    95    90   1.10000 -1.0 2.0
   95    97    96    99   1.10000 -1.0 2.0
   97   111   101   102  10.50000 -1.0 2.0
  112   101   111    95   1.00000 -1.0 2.0
  107   100    99    96   1.10000 -1.0 2.0
   93    85    92    94  10.50000 -1.0 2.0
   73    68    72    74  10.50000 -1.0 2.0
END
