* LIGAND DATABASE FILE (OPLS2005)
*
001      99   103    194    321     589
    1     0 S   NP   _N1_     1    28.63157    95.69554   -21.52387
    2     1 S   H    _HN1     2     1.02950    81.69233    11.69930
    3     1 S   H    _H1_     3     1.02832    36.78623   145.44003
    4     1 S   H    _H2_     4     1.02785    91.85770   -96.57180
    5     1 S   CT   _CA1     5     1.50111   146.41564   126.37716
    6     5 S   HC   _HA1     6     1.09572   105.22038    71.32851
    7     5 S   CO3  _C1_     7     1.53801   112.36104   -48.95123
    8     7 S   O2Z  _O11     8     1.26374   115.00726   -44.59328
    9     7 S   O2Z  _O12     9     1.26231   114.93870   134.49462
   10     5 S   CT   _CB1    10     1.53076   107.42743  -170.68991
   11    10 S   HC   HB11    11     1.09831   109.44123   -49.67354
   12    10 S   HC   HB12    12     1.09814   110.42698    66.94355
   13    10 S   CT   _CG1    13     1.52988   112.57756  -170.64424
   14    13 S   HC   HG11    14     1.09592   110.59367   -63.95547
   15    13 S   HC   HG12    15     1.09663   109.84940    55.28342
   16    13 S   C    _CD1    16     1.51794   112.22761   175.77154
   17    16 S   O    _OE1    17     1.22736   123.27004     4.54722
   18    16 S   N    _N2_    18     1.38612   111.63388  -175.65427
   19    18 S   H    _HN2    19     1.01589   119.08086     1.87951
   20    18 S   CT1  _CA2    20     1.46316   123.47125   179.27180
   21    20 S   HC   _HA2    21     1.09756   109.28589     1.43777
   22    20 S   C    _C2_    22     1.53598   108.93797  -113.97456
   23    22 S   O    _O2_    23     1.23059   122.31812  -151.38101
   24    20 S   CT   _CB2    32     1.53842   111.38589   123.27104
   25    24 S   HC   HB21    33     1.09301   108.27720    55.63735
   26    24 S   HC   HB22    34     1.09092   109.01918   174.84938
   27    22 S   N    _N3_    24     1.38355   113.77451    36.32120
   28    27 S   H    _HN3    25     1.01580   119.52693    -3.71367
   29    24 S   S    _SG2    35     1.82663   110.06964   -64.49231
   30    27 S   CT   _CA3    26     1.45269   123.16483   176.96320
   31    30 S   HC   HA31    27     1.09551   107.54988   -63.57083
   32    30 S   HC   HA32    28     1.09559   107.93140    52.84362
   33    29 S   CT   _C18    36     1.99387   107.45800  -176.47847
   34    30 S   CO3  _C3_    29     1.52938   114.12879   174.83195
   35    34 S   O2Z  _O31    30     1.26373   116.09474     0.00000
   36    34 S   O2Z  _O32    31     1.26436   114.40328  -179.95154
   37    33 S   CT   _C19    37     1.57939   111.24158   -36.31686
   38    37 S   OM   _O39    38     1.32057   111.74177    69.28209
   39    37 S   HC   _H6_    39     1.09622   107.22823  -163.09427
   40    33 S   CT   _C17    77     1.67324   109.91854    93.64619
   41    37 S   CO4  _C20    40     1.53378   112.71856   -53.66354
   42    41 S   O    _O36    41     1.22973   124.62015   142.63089
   43    40 S   CT   _C26    78     1.55237   109.52830   -33.04164
   44    43 S   HC   _H20    79     1.09140   113.37481    67.06581
   45    43 S   HC   _H21    80     1.09269   110.88990   -55.97196
   46    43 S   HC   _H22    81     1.08710   114.65621  -172.75638
   47    41 S   OS   _O37    42     1.35907   115.27807   -46.02636
   48    47 S   CT   _C21    43     1.45156   123.70379    36.69690
   49    48 S   HC   _H7_    44     1.09589   104.52874    81.13359
   50    48 S   C5BC _C22    45     1.51180   109.21429  -168.42236
   51    33 S   CT   _C5_    53     1.61284   102.57107  -148.75168
   52    50 S   C5BC _C23    46     1.42616   127.94963    33.24843
   53    52 S   HA   _H17    47     1.08093   127.34573     0.95920
   54    51 S   CT   _C6_    54     1.57047   110.59964   -61.49815
   55    54 S   HC   _H11    55     1.09822   108.32888  -156.81169
   56    54 S   HC   _H12    56     1.09734   110.10837    88.95303
   57    51 S   CT   _C4_    96     1.56713   112.72971   175.92105
   58    57 S   HC   _H8_    97     1.09556   112.08681   -79.24623
   59    57 S   HC   _H9_    98     1.09610   111.40759   161.82829
   60    57 S   HC   _H10    99     1.08642   114.60349    41.06725
   61    52 S   C5A  _C24    48     1.37431   106.68947  -179.13815
   62    61 S   HA   _H18    49     1.08019   133.82135  -179.77445
   63    54 S   CT   _C7_    57     1.54296   116.91789   -35.53007
   64    63 S   HC   _H3_    58     1.09122   106.12172  -145.76831
   65    61 S   OA   _O38    50     1.35639   110.47432     0.58517
   66    63 S   CT   _C8_    59     1.54097   112.20432   -23.47998
   67    66 S   HC   _H4_    60     1.09576   103.10556   -50.93502
   68    63 S   OH   _O40    94     1.42172   111.09204   101.12121
   69    68 S   HO   _H32    95     0.97208   108.14317    52.57930
   70    50 S   C5A  _C25    51     1.38230   127.10771  -144.53488
   71    70 S   HA   _H19    52     1.08070   133.42988    -0.82139
   72    66 S   CT   _C9_    61     1.61486   117.03926  -159.13695
   73    72 S   CM   _C10    62     1.55189   107.64885    59.08508
   74    73 S   HC   _H13    63     1.08628   116.46720   -28.39398
   75    72 S   CT   _C14    70     1.59791   109.08231   174.85524
   76    75 S   HC   _H5_    71     1.10418   102.91331   -73.63125
   77    72 S   CT   _C29    90     1.53962   112.43367   -55.01002
   78    77 S   HC   _H29    91     1.08696   113.95259   -66.80996
   79    77 S   HC   _H30    92     1.09501   112.29631   172.15110
   80    77 S   HC   _H31    93     1.09523   111.58394    54.77466
   81    73 S   CM   _C11    64     1.34097   130.59558   149.97728
   82    81 S   HC   _H14    65     1.08744   118.53028  -176.27737
   83    75 S   CT   _C15    72     1.53872   116.32310    37.32063
   84    83 S   HC   _H15    73     1.09748   109.40989  -160.71656
   85    83 S   HC   _H16    74     1.08979   113.98166    82.32436
   86    81 S   CO4  _C12    66     1.46947   127.23464     4.45672
   87    86 S   O    _O33    67     1.22333   122.18025  -165.23754
   88    83 S   CO4  _C16    75     1.51446   111.73375   -42.85202
   89    88 S   O    _O35    76     1.22900   118.34181  -114.66769
   90    86 S   OS   _O34    68     1.34947   113.01069    23.95066
   91    90 S   CT   _C13    69     1.44790   118.09929   -85.83698
   92    91 S   CT   _C27    82     1.53974   104.88444  -176.12991
   93    92 S   HC   _H23    83     1.09721   110.34913    49.97975
   94    92 S   HC   _H24    84     1.09158   112.32529   -67.77754
   95    92 S   HC   _H25    85     1.09421   112.47182   169.85978
   96    91 S   CT   _C28    86     1.54569   108.17433   -62.51308
   97    96 S   HC   _H26    87     1.09651   110.67661   -48.60829
   98    96 S   HC   _H27    88     1.09424   112.17959  -169.36448
   99    96 S   HC   _H28    89     1.09561   111.39791    69.55723
  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  13   5   4   3
  29   2   1   1  13   6   5  23   6   2  11   4   3   2   8  17
   6  10  14   6   4  13   6   5   4   2   1   1   4   2  10   5
   2  17   6   2   1   1   1  19  14   5  22   9   6   2   1   1
   5   3   8   4   3   5   2   2   1   9   8   7   3   2   1   3
   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    51    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    41    48    51    54    66    88    40    43    57  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    41    42    47    48    49    50    51    54    55    56    63    66    67    72    83    88    89    40    43    44    45    46    57    58    59    60  
   35    36  
   36  
    0  
   38    39    41    42    47    48    51    54    66    88    40    43    57  
   39    41    42    47    51    40  
   41    42    47    51    40  
   43    44    45    46    77    68    57    41    48    51    54    63    64    66    67    72    73    75    83    84    85    88    89  
   42    47    48    49    50    51  
   47    48  
   44    45    46    51    63    66    67    72    83    88    89  
   45    46    66    88  
   46    66    88  
   66    88  
   48    49    50    52    70    51    54    57  
   49    50    52    53    61    65    70    71    51    54    55    56    63    57    58    59    60  
   50    52    70    51    54    57  
   52    53    61    62    65    70    71    51    54    57  
   54    55    56    63    64    66    88    68    57    58    59    60    52    70  
   53    61    62    65    70    71  
   61    62    65    70  
   55    56    63    64    66    67    72    68    69    57    58    59    60  
   56    63    64    66    68    57  
   63    64    66    68    57  
   58    59    60    63  
   59    60  
   60  
    0  
   62    65    70    71  
   65    70  
   64    66    67    72    73    75    88    77    68    69  
   66    67    72    68    69  
   70    71  
   67    72    73    74    81    91    75    76    83    88    89    77    78    79    80    68    69  
   72    73    75    88    77    68  
   69    72  
    0  
   71  
    0  
   73    74    81    82    86    90    91    75    76    83    84    85    88    92    96    77    78    79    80  
   74    81    82    86    87    90    91    75    76    83    77    78    79    80  
   81    82    86    75    77  
   76    83    84    85    88    89    92    93    94    95    96    97    98    99    77    78    79    80    81    86    90    91  
   83    84    85    88    92    96    77    90    91  
   78    79    80    81    83    91  
   79    80  
   80  
    0  
   82    86    87    90    91  
   86    87    90  
   84    85    88    89    92    96    90    91  
   85    88    89    91  
   88    89    91  
   87    90    91    92    96  
   90    91  
   89    91  
    0  
   91    92    93    94    95    96    97    98    99  
   92    93    94    95    96    97    98    99  
   93    94    95    96    97    98    99  
   94    95    96  
   95    96  
   96  
   97    98    99  
   98    99  
   99  
    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   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   38   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   39   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   40   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   41   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   48   3.5000   0.0660   0.335000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   50   3.5500   0.0760  -0.143000   2.0020   1.7750   0.001000000  -0.843144165
   51   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   52   3.5500   0.0760  -0.154000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.126000   1.3810   1.2100   0.030040813   0.268726247
   54   3.5000   0.0660  -0.120000   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   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   63   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.9000   0.1400  -0.190000   1.6450   1.4500   0.001000000  -0.126889456
   66   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   69   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   70   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   71   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   72   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   73   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   74   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   75   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   3.5000   0.0660  -0.180000   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   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   82   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   83   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   84   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   85   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   86   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   87   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   88   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   89   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   90   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   91   3.5000   0.0660   0.250000   1.9750   1.7500   0.005000000  -0.741685710
   92   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   268.000  1.529
   33    51   268.000  1.529
   33    40   268.000  1.529
   37    38   570.000  1.307
   37    39   340.000  1.090
   37    41   317.000  1.522
   41    42   570.000  1.229
   41    47   214.000  1.327
   47    48   320.000  1.410
   48    49   340.000  1.090
   48    50   285.000  1.502
   48    51   268.000  1.529
   50    52   469.000  1.424
   50    70   546.000  1.367
   52    53   367.000  1.080
   52    61   546.000  1.367
   61    62   367.000  1.080
   61    65   340.000  1.360
   65    70   340.000  1.360
   70    71   367.000  1.080
   51    54   268.000  1.529
   51    57   268.000  1.529
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    63   268.000  1.529
   63    64   340.000  1.090
   63    66   268.000  1.529
   63    68   320.000  1.410
   66    67   340.000  1.090
   66    72   268.000  1.529
   66    40   268.000  1.529
   72    73   317.000  1.510
   72    75   268.000  1.529
   72    77   268.000  1.529
   73    74   340.000  1.080
   73    81   549.000  1.340
   81    82   340.000  1.080
   81    86   320.000  1.462
   86    87   570.000  1.229
   86    90   214.000  1.327
   90    91   320.000  1.410
   91    75   268.000  1.529
   91    92   268.000  1.529
   91    96   268.000  1.529
   75    76   340.000  1.090
   75    83   268.000  1.529
   83    84   340.000  1.090
   83    85   340.000  1.090
   83    88   317.000  1.522
   88    89   570.000  1.229
   88    40   317.000  1.522
   40    43   268.000  1.529
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    46   340.000  1.090
   92    93   340.000  1.090
   92    94   340.000  1.090
   92    95   340.000  1.090
   96    97   340.000  1.090
   96    98   340.000  1.090
   96    99   340.000  1.090
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    80   340.000  1.090
   68    69   553.000  0.945
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   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  111.63000
   29    33    51    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    37    38    50.00000  109.50000
   33    37    39    37.50000  110.70000
   33    37    41    63.00000  111.10000
   33    51    48    58.35000  112.70000
   33    51    54    58.35000  112.70000
   33    51    57    58.35000  112.70000
   33    40    66    58.35000  112.70000
   33    40    88    63.00000  111.10000
   33    40    43    58.35000  112.70000
   37    41    42    80.00000  120.40000
   37    41    47    81.00000  111.40000
   39    37    38    45.00000  125.66300
   41    37    38    90.00000  108.74100
   41    37    39    35.00000  109.50000
   41    47    48    83.00000  116.90000
   47    41    42    83.00000  123.40000
   47    48    49    35.00000  109.50000
   47    48    50    85.00000  111.85700
   47    48    51    50.00000  109.50000
   48    50    52    60.00000  130.00000
   48    50    70    60.00000  130.00000
   48    51    54    58.35000  112.70000
   48    51    57    58.35000  112.70000
   50    48    49    35.00000  109.50000
   50    52    53    35.00000  127.50000
   50    52    61    70.00000  107.30000
   50    70    65    70.00000  110.60000
   50    70    71    35.00000  132.10000
   52    61    62    35.00000  132.10000
   52    61    65    70.00000  110.60000
   61    52    53    35.00000  125.70000
   61    65    70    70.00000  106.50000
   65    61    62    35.00000  113.40000
   65    70    71    35.00000  113.40000
   70    50    52    70.00000  107.30000
   51    33    37    58.35000  112.70000
   51    48    49    37.50000  110.70000
   51    48    50    70.00000  112.17500
   51    54    55    37.50000  110.70000
   51    54    56    37.50000  110.70000
   51    54    63    58.35000  112.70000
   51    57    58    37.50000  110.70000
   51    57    59    37.50000  110.70000
   51    57    60    37.50000  110.70000
   54    63    64    37.50000  110.70000
   54    63    66    58.35000  112.70000
   54    63    68    50.00000  109.50000
   56    54    55    33.00000  107.80000
   63    54    55    37.50000  110.70000
   63    54    56    37.50000  110.70000
   63    66    67    37.50000  110.70000
   63    66    72    58.35000  112.70000
   63    66    40    58.35000  112.70000
   63    68    69    55.00000  108.50000
   66    63    64    37.50000  110.70000
   66    72    73    70.00000  112.02700
   66    72    75    58.35000  112.70000
   66    72    77    58.35000  112.70000
   66    40    88    63.00000  111.10000
   66    40    43    58.35000  112.70000
   72    66    67    37.50000  110.70000
   72    73    74    35.00000  117.00000
   72    73    81    70.00000  124.00000
   72    75    91    58.35000  112.70000
   72    75    76    37.50000  110.70000
   72    75    83    58.35000  112.70000
   72    77    78    37.50000  110.70000
   72    77    79    37.50000  110.70000
   72    77    80    37.50000  110.70000
   73    81    82    35.00000  120.00000
   73    81    86    65.00000  118.96000
   81    73    74    35.00000  120.00000
   81    86    87    80.00000  123.72100
   81    86    90    90.00000  111.29400
   86    81    82    40.00000  117.72500
   86    90    91    83.00000  116.90000
   90    86    87    83.00000  123.40000
   90    91    75    50.00000  109.50000
   90    91    92    50.00000  109.50000
   90    91    96    50.00000  109.50000
   91    75    76    37.50000  110.70000
   91    75    83    58.35000  112.70000
   91    92    93    37.50000  110.70000
   91    92    94    37.50000  110.70000
   91    92    95    37.50000  110.70000
   91    96    97    37.50000  110.70000
   91    96    98    37.50000  110.70000
   91    96    99    37.50000  110.70000
   75    72    73    70.00000  112.02700
   75    83    84    37.50000  110.70000
   75    83    85    37.50000  110.70000
   75    83    88    63.00000  111.10000
   83    75    76    37.50000  110.70000
   83    88    89    80.00000  120.40000
   83    88    40    70.00000  116.00000
   85    83    84    33.00000  107.80000
   88    83    84    35.00000  109.50000
   88    83    85    35.00000  109.50000
   88    40    43    63.00000  111.10000
   40    33    37    58.35000  112.70000
   40    33    51    58.35000  112.70000
   40    66    67    37.50000  110.70000
   40    66    72    58.35000  112.70000
   40    88    89    80.00000  120.40000
   40    43    44    37.50000  110.70000
   40    43    45    37.50000  110.70000
   40    43    46    37.50000  110.70000
   45    43    44    33.00000  107.80000
   46    43    44    33.00000  107.80000
   46    43    45    33.00000  107.80000
   92    91    75    58.35000  112.70000
   94    92    93    33.00000  107.80000
   95    92    93    33.00000  107.80000
   95    92    94    33.00000  107.80000
   96    91    75    58.35000  112.70000
   96    91    92    58.35000  112.70000
   98    96    97    33.00000  107.80000
   99    96    97    33.00000  107.80000
   99    96    98    33.00000  107.80000
   77    72    73    70.00000  112.02700
   77    72    75    58.35000  112.70000
   79    77    78    33.00000  107.80000
   80    77    78    33.00000  107.80000
   80    77    79    33.00000  107.80000
   68    63    64    35.00000  109.50000
   68    63    66    50.00000  109.50000
   57    51    54    58.35000  112.70000
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    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   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    51   0.01700  1.0 1.0
   24    29    33    51  -0.23550 -1.0 2.0
   24    29    33    51   0.21350  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
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   77    72    73    81   0.15250 -1.0 2.0
   77    72    73    81  -0.50650  1.0 3.0
   77    72    75    91   0.56750  1.0 1.0
   77    72    75    91  -0.07550 -1.0 2.0
   77    72    75    91   0.20000  1.0 3.0
   77    72    75    76   0.15000  1.0 3.0
   77    72    75    83   0.56750  1.0 1.0
   77    72    75    83  -0.07550 -1.0 2.0
   77    72    75    83   0.20000  1.0 3.0
   68    63    66    67   0.23400  1.0 3.0
   68    63    66    72   0.86500  1.0 1.0
   68    63    66    72  -0.17500 -1.0 2.0
   68    63    66    72   0.20800  1.0 3.0
   68    63    66    40   0.86500  1.0 1.0
   68    63    66    40  -0.17500 -1.0 2.0
   68    63    66    40   0.20800  1.0 3.0
   57    51    54    55   0.15000  1.0 3.0
   57    51    54    56   0.15000  1.0 3.0
   57    51    54    63   0.56750  1.0 1.0
   57    51    54    63  -0.07550 -1.0 2.0
   57    51    54    63   0.20000  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
   37    47    41    42  10.50000 -1.0 2.0
   52    70    50    48   4.00000 -1.0 2.0
   61    53    52    50   1.10000 -1.0 2.0
   65    62    61    52   1.10000 -1.0 2.0
   65    71    70    50   1.10000 -1.0 2.0
   72    74    73    81   1.10000 -1.0 2.0
   86    82    81    73   1.10000 -1.0 2.0
   81    90    86    87  10.50000 -1.0 2.0
   83    40    88    89  10.50000 -1.0 2.0
END
