* LIGAND DATABASE FILE (OPLS2005)
*
001      89    91    166    254     487
    1     0 S   NP   _N1_     1    28.96976    97.09634   -19.20910
    2     1 S   H    _HN1     2     1.02790    84.16533  -106.63157
    3     1 S   H    _H1_     3     1.02936    71.51583     4.81414
    4     1 S   H    _H2_     4     1.02845    52.37957   135.56749
    5     1 S   CT   _CA1     5     1.50109   160.84522   104.49957
    6     5 S   HC   _HA1     6     1.09604   105.17766    85.74592
    7     5 S   CO3  _C1_     7     1.53833   111.83986   -33.95063
    8     7 S   O2Z  _O11     8     1.26337   115.22803   -59.74398
    9     7 S   O2Z  _O12     9     1.26243   114.76497   118.84279
   10     5 S   CT   _CB1    10     1.53059   107.32712  -156.97344
   11    10 S   HC   HB11    11     1.09824   109.28944   -52.45728
   12    10 S   HC   HB12    12     1.09804   110.62631    64.08743
   13    10 S   CT   _CG1    13     1.52916   112.42855  -173.50375
   14    13 S   HC   HG11    14     1.09608   110.41556   -62.49075
   15    13 S   HC   HG12    15     1.09663   110.06633    56.54261
   16    13 S   C    _CD1    16     1.51837   112.20762   176.59953
   17    16 S   O    _OE1    17     1.22730   123.41404    -7.78868
   18    16 S   N    _N2_    18     1.38469   111.56747   173.06008
   19    18 S   H    _HN2    19     1.01586   118.60453     0.23903
   20    18 S   CT1  _CA2    20     1.46009   123.18223   178.15804
   21    20 S   HC   _HA2    21     1.09730   108.47612    25.89626
   22    20 S   C    _C2_    22     1.53297   110.59919   -90.70575
   23    22 S   O    _O2_    23     1.23167   120.89244   164.79466
   24    20 S   CT   _CB2    32     1.53300   111.80042   148.20870
   25    24 S   HC   HB21    33     1.09223   110.25096    61.33900
   26    24 S   HC   HB22    34     1.09567   110.16860   178.68836
   27    22 S   N    _N3_    24     1.38115   114.91741   -21.07387
   28    27 S   H    _HN3    25     1.01558   119.48189     5.70619
   29    24 S   S    _SG2    35     1.82599   111.30440   -62.38950
   30    27 S   CT   _CA3    26     1.45323   123.04197  -176.72727
   31    30 S   HC   HA31    27     1.09542   108.33507   -48.18418
   32    30 S   HC   HA32    28     1.09566   107.15742    68.21359
   33    29 S   CT   _C14    36     1.84809   100.76938   136.72445
   34    33 S   HC   _H7_    37     1.09953   104.60486    44.03318
   35    30 S   CO3  _C3_    29     1.52881   114.05156  -169.94163
   36    35 S   O2Z  _O31    30     1.26368   115.93888    18.48525
   37    35 S   O2Z  _O32    31     1.26420   114.59417  -161.46955
   38    33 S   CT   _C15    38     1.55827   109.67557   -73.62030
   39    38 S   HC   _H8_    39     1.09530   111.24519   -24.41696
   40    33 S   CT   _C13    52     1.58162   115.80066   166.57844
   41    40 S   OM   _O40    53     1.33323   107.11488  -131.92176
   42    38 S   CT   _C8_    40     1.53227   104.99389  -144.40695
   43    42 S   HC   _H4_    41     1.09979   108.15574   -78.78930
   44    40 S   CT   _C23    54     1.54995   118.39287   -12.89053
   45    44 S   HC   _H26    55     1.09849   111.38871   179.65736
   46    44 S   HC   _H27    56     1.09271   112.53428    60.27029
   47    38 S   OS   _O36    75     1.44131   109.49815    98.33023
   48    42 S   CT   _C7_    42     1.52567   115.81265   161.96804
   49    48 S   HC   _H14    43     1.09562   111.49564    49.26014
   50    48 S   HC   _H15    44     1.09911   107.75552   164.60254
   51    44 S   OH   _O39    57     1.42926   112.23767   -60.09402
   52    51 S   HO   _H28    58     0.97395   105.59723   -42.94855
   53    47 S   CO4  _C16    76     1.35499   118.07586  -140.40742
   54    53 S   O    _O37    77     1.22075   126.61382    -1.90516
   55    48 S   CO   _C6_    45     1.52431   113.17433   -76.07892
   56    55 S   HC   _H3_    46     1.09694   110.17881    68.71770
   57    53 S   CA   _C17    78     1.48361   110.15013   175.84221
   58    55 S   OS   _O34    47     1.42945   109.37758   -52.97761
   59    55 S   OS   _O33    67     1.43293   107.17860  -173.81043
   60    57 S   CA   _C18    79     1.40115   118.04385  -175.39330
   61    60 S   HA   _H21    80     1.08759   121.08301    -0.67464
   62    58 S   CO   _C10    48     1.43284   112.58451    65.31271
   63    62 S   HC   _H6_    49     1.09695   106.67867   179.27368
   64    59 S   CT   _C5_    68     1.42599   112.11790  -173.55825
   65    64 S   HC   _H12    69     1.09514   109.78290   -65.22147
   66    64 S   HC   _H13    70     1.09416   110.04259    54.77814
   67    60 S   CA   _C19    81     1.39585   120.30347   178.44594
   68    67 S   HA   _H22    82     1.08640   119.39892  -179.19133
   69    42 S   CT   _C9_    50     1.54099   103.43146    37.89195
   70    69 S   HC   _H5_    51     1.10202   107.04397  -160.54706
   71    62 S   OS   _O35    59     1.42756   112.22578    60.90233
   72    64 S   CT   _C4_    71     1.51545   108.40444   174.88481
   73    72 S   HC   _H9_    72     1.09505   110.58704   -59.28921
   74    72 S   HC   _H10    73     1.09499   110.63740    59.00205
   75    72 S   HC   _H11    74     1.09357   110.89572   179.90109
   76    67 S   CA   _C20    83     1.39194   119.57270     0.12667
   77    71 S   CT   _C11    60     1.42536   112.87223    67.49046
   78    77 S   HC   _H16    61     1.09501   110.10590   -60.43333
   79    77 S   HC   _H17    62     1.09530   109.79064    59.81166
   80    76 S   CA   _C21    84     1.39165   120.73778     0.38816
   81    80 S   HA   _H23    85     1.08641   120.42216   179.92867
   82    76 S   OH   _O38    88     1.36602   121.01099  -179.41416
   83    82 S   HO   _H25    89     0.97281   108.42222     3.48155
   84    77 S   CT   _C12    63     1.51553   108.27526   179.68102
   85    84 S   HC   _H18    64     1.09484   110.65618   -59.76295
   86    84 S   HC   _H19    65     1.09406   110.57046    58.51229
   87    84 S   HC   _H20    66     1.09347   110.93031   179.36511
   88    57 S   CA   _C22    86     1.40155   122.41087     3.54210
   89    88 S   HA   _H24    87     1.08668   121.62793     1.14055
  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
  17   8   2   1   1  17   7  16   8  16   8   7   4   3   7  10
   6   5   2   1   8   3  11   4   9   8   8   8   4   8   4   6
   5   4   7   3   3   1   7   3   2   1   1   6   6   5   4   5
   3   2   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    42    69    40    41    44    47  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    43    48    62    69    70    40    41    44    45    46    51    47    53  
   38    39    42    69    40    41    44    47  
   36    37  
   37  
    0  
   39    42    43    48    49    50    55    62    69    70    40    41    44    47    53    54    57  
   42    43    48    69    40    47    53  
   41    44    45    46    51    52    71    47    42    43    48    58    62    63    69    70  
   44    45    46    51    42    62    69    70  
   43    48    49    50    55    56    58    62    63    69    70    44    71    59    47    53  
   48    49    50    55    62    69    70    47  
   45    46    51    52    62    69    70  
   46    51    52    69  
   51    52    69  
   53    54    57    60    88    48    69  
   49    50    55    56    58    62    69    70    59    64  
   50    55    56    58    69    59  
   55    56    58    69    59  
   52    69  
    0  
   54    57    60    61    67    80    88    89  
   57    60    88  
   56    58    62    63    69    71    59    64    65    66    72  
   58    62    59    64  
   60    61    67    68    76    80    81    88    89  
   62    63    69    70    71    77    59    64  
   64    65    66    72    73    74    75    62  
   61    67    68    76    80    88    89    82  
   67    68    76    88  
   63    69    70    71    77    78    79    84  
   69    70    71    77  
   65    66    72    73    74    75  
   66    72    73    74    75  
   72    73    74    75  
   68    76    80    81    88    82    83  
   76    80    82  
   70    71    77  
   71  
   77    78    79    84    85    86    87  
   73    74    75  
   74    75  
   75  
    0  
   80    81    88    89    82    83  
   78    79    84    85    86    87  
   79    84    85    86    87  
   84    85    86    87  
   81    88    89    82    83  
   88    89    82  
   83    88  
    0  
   85    86    87  
   86    87  
   87  
    0  
   89  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   40   4.2000   0.3000  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   41   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   48   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   52   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   53   3.7500   0.1050   0.625000   2.1120   1.8750   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   55   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   58   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   59   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   60   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   61   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   62   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   68   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   69   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   72   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   77   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   79   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   80   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   81   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   82   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   83   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   84   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   89   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   268.000  1.529
   33    40   268.000  1.529
   38    39   340.000  1.090
   38    42   268.000  1.529
   38    47   320.000  1.410
   42    43   340.000  1.090
   42    48   268.000  1.529
   42    69   268.000  1.529
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    55   250.000  1.527
   55    56   340.000  1.090
   55    58   320.000  1.380
   55    59   320.000  1.380
   58    62   320.000  1.380
   62    63   340.000  1.090
   62    69   250.000  1.527
   62    71   320.000  1.380
   69    70   340.000  1.090
   69    40   268.000  1.529
   40    41   570.000  1.307
   40    44   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    51   320.000  1.410
   51    52   553.000  0.945
   71    77   320.000  1.410
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    84   268.000  1.529
   84    85   340.000  1.090
   84    86   340.000  1.090
   84    87   340.000  1.090
   59    64   320.000  1.410
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    72   268.000  1.529
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    75   340.000  1.090
   47    53   214.000  1.327
   53    54   570.000  1.229
   53    57   310.000  1.470
   57    60   469.000  1.400
   57    88   469.000  1.400
   60    61   367.000  1.080
   60    67   469.000  1.400
   67    68   367.000  1.080
   67    76   469.000  1.400
   76    80   469.000  1.400
   76    82   450.000  1.364
   80    81   367.000  1.080
   80    88   469.000  1.400
   88    89   367.000  1.080
   82    83   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    42    58.35000  112.70000
   33    38    47    50.00000  109.50000
   33    40    69    58.35000  112.70000
   33    40    41    50.00000  109.50000
   33    40    44    58.35000  112.70000
   38    33    34    37.50000  110.70000
   38    42    43    37.50000  110.70000
   38    42    48    58.35000  112.70000
   38    42    69    58.35000  112.70000
   38    47    53    83.00000  116.90000
   42    38    39    37.50000  110.70000
   42    48    49    37.50000  110.70000
   42    48    50    37.50000  110.70000
   42    48    55    75.00000  109.43000
   42    69    62    75.00000  109.43000
   42    69    70    37.50000  110.70000
   42    69    40    58.35000  112.70000
   48    42    43    37.50000  110.70000
   48    55    56    45.00000  112.01100
   48    55    58    90.00000  108.56700
   48    55    59    90.00000  108.56700
   50    48    49    33.00000  107.80000
   55    48    49    45.00000  108.72000
   55    48    50    45.00000  108.72000
   55    58    62   100.00000  109.58800
   55    59    64    60.00000  109.50000
   58    55    56    35.00000  109.50000
   58    62    63    35.00000  109.50000
   58    62    69    90.00000  108.56700
   58    62    71    92.60000  111.55000
   62    69    70    45.00000  108.72000
   62    69    40    75.00000  109.43000
   62    71    77    60.00000  109.50000
   69    42    43    37.50000  110.70000
   69    42    48    58.35000  112.70000
   69    62    63    45.00000  112.01100
   69    40    41    50.00000  109.50000
   69    40    44    58.35000  112.70000
   40    33    34    37.50000  110.70000
   40    33    38    58.35000  112.70000
   40    69    70    37.50000  110.70000
   40    44    45    37.50000  110.70000
   40    44    46    37.50000  110.70000
   40    44    51    50.00000  109.50000
   44    40    41    50.00000  109.50000
   44    51    52    55.00000  108.50000
   46    44    45    33.00000  107.80000
   51    44    45    35.00000  109.50000
   51    44    46    35.00000  109.50000
   71    62    63    35.00000  109.50000
   71    62    69    90.00000  108.56700
   71    77    78    35.00000  109.50000
   71    77    79    35.00000  109.50000
   71    77    84    50.00000  109.50000
   77    84    85    37.50000  110.70000
   77    84    86    37.50000  110.70000
   77    84    87    37.50000  110.70000
   79    77    78    33.00000  107.80000
   84    77    78    37.50000  110.70000
   84    77    79    37.50000  110.70000
   86    84    85    33.00000  107.80000
   87    84    85    33.00000  107.80000
   87    84    86    33.00000  107.80000
   59    55    56    35.00000  109.50000
   59    55    58    92.60000  111.55000
   59    64    65    35.00000  109.50000
   59    64    66    35.00000  109.50000
   59    64    72    50.00000  109.50000
   64    72    73    37.50000  110.70000
   64    72    74    37.50000  110.70000
   64    72    75    37.50000  110.70000
   66    64    65    33.00000  107.80000
   72    64    65    37.50000  110.70000
   72    64    66    37.50000  110.70000
   74    72    73    33.00000  107.80000
   75    72    73    33.00000  107.80000
   75    72    74    33.00000  107.80000
   47    38    39    35.00000  109.50000
   47    38    42    50.00000  109.50000
   47    53    54    83.00000  123.40000
   47    53    57    81.00000  111.40000
   53    57    60    60.00000  119.52600
   53    57    88    60.00000  119.52600
   57    53    54    75.00000  123.78400
   57    60    61    35.00000  120.00000
   57    60    67    63.00000  120.00000
   57    88    80    63.00000  120.00000
   57    88    89    35.00000  120.00000
   60    67    68    35.00000  120.00000
   60    67    76    63.00000  120.00000
   67    60    61    35.00000  120.00000
   67    76    80    63.00000  120.00000
   67    76    82    70.00000  120.00000
   76    67    68    35.00000  120.00000
   76    80    81    35.00000  120.00000
   76    80    88    63.00000  120.00000
   76    82    83    35.00000  113.00000
   80    88    89    35.00000  120.00000
   88    57    60    63.00000  120.00000
   88    80    81    35.00000  120.00000
   82    76    80    70.00000  120.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    42   0.44750  1.0 1.0
   29    33    38    42  -0.17800 -1.0 2.0
   29    33    38    42   0.20200  1.0 3.0
   29    33    38    47   0.56750  1.0 1.0
   29    33    38    47  -0.07550 -1.0 2.0
   29    33    38    47   0.20000  1.0 3.0
   29    33    40    69   0.44750  1.0 1.0
   29    33    40    69  -0.17800 -1.0 2.0
   29    33    40    69   0.20200  1.0 3.0
   29    33    40    41   0.56750  1.0 1.0
   29    33    40    41  -0.07550 -1.0 2.0
   29    33    40    41   0.20000  1.0 3.0
   29    33    40    44   0.44750  1.0 1.0
   29    33    40    44  -0.17800 -1.0 2.0
   29    33    40    44   0.20200  1.0 3.0
   33    38    42    43   0.15000  1.0 3.0
   33    38    42    48   0.56750  1.0 1.0
   33    38    42    48  -0.07550 -1.0 2.0
   33    38    42    48   0.20000  1.0 3.0
   33    38   -42    69   0.56750  1.0 1.0
   33    38   -42    69  -0.07550 -1.0 2.0
   33    38   -42    69   0.20000  1.0 3.0
   33    38    47    53  -0.25900  1.0 1.0
   33    38    47    53  -0.47000 -1.0 2.0
   33    38    47    53   0.11750  1.0 3.0
   33    40    44    45   0.15000  1.0 3.0
   33    40    44    46   0.15000  1.0 3.0
   33    40    44    51   0.86500  1.0 1.0
   33    40    44    51  -0.17500 -1.0 2.0
   33    40    44    51   0.20800  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    42   0.15000  1.0 3.0
   34    33    38    47   0.23400  1.0 3.0
   34    33    40    69   0.15000  1.0 3.0
   34    33    40    41   0.23400  1.0 3.0
   34    33    40    44   0.15000  1.0 3.0
   38    33   -40    69   0.56750  1.0 1.0
   38    33   -40    69  -0.07550 -1.0 2.0
   38    33   -40    69   0.20000  1.0 3.0
   38    33    40    41   0.62750  1.0 1.0
   38    33    40    41  -0.30950 -1.0 2.0
   38    33    40    41   0.27300  1.0 3.0
   38    33    40    44   0.56750  1.0 1.0
   38    33    40    44  -0.07550 -1.0 2.0
   38    33    40    44   0.20000  1.0 3.0
   38    42    48    49   0.15000  1.0 3.0
   38    42    48    50   0.15000  1.0 3.0
   38    42    48    55   3.97050  1.0 1.0
   38    42    69    62   3.97050  1.0 1.0
   38    42    69    70   0.15000  1.0 3.0
   38    42   -69    40   0.56750  1.0 1.0
   38    42   -69    40  -0.07550 -1.0 2.0
   38    42   -69    40   0.20000  1.0 3.0
   38    47    53    54   3.00000 -1.0 2.0
   38    47    53    57   0.59950  1.0 1.0
   38    47    53    57   3.24850 -1.0 2.0
   39    38    42    43   0.15000  1.0 3.0
   39    38    42    48   0.15000  1.0 3.0
   39    38    42    69   0.15000  1.0 3.0
   39    38    47    53   0.08050  1.0 3.0
   42    38    47    53  -0.25900  1.0 1.0
   42    38    47    53  -0.47000 -1.0 2.0
   42    38    47    53   0.11750  1.0 3.0
   42    48    55    56   0.15000  1.0 3.0
   42    48    55    58   0.62750  1.0 1.0
   42    48    55    58  -0.30950 -1.0 2.0
   42    48    55    58   0.27300  1.0 3.0
   42    48    55    59   0.62750  1.0 1.0
   42    48    55    59  -0.30950 -1.0 2.0
   42    48    55    59   0.27300  1.0 3.0
   42    69   -40    33   0.56750  1.0 1.0
   42    69   -40    33  -0.07550 -1.0 2.0
   42    69   -40    33   0.20000  1.0 3.0
   42    69    40    41   0.62750  1.0 1.0
   42    69    40    41  -0.30950 -1.0 2.0
   42    69    40    41   0.27300  1.0 3.0
   42    69    40    44   0.56750  1.0 1.0
   42    69    40    44  -0.07550 -1.0 2.0
   42    69    40    44   0.20000  1.0 3.0
   43    42    48    49   0.15000  1.0 3.0
   43    42    48    50   0.15000  1.0 3.0
   43    42    48    55   0.15000  1.0 3.0
   43    42    69    62   0.15000  1.0 3.0
   43    42    69    70   0.15000  1.0 3.0
   43    42    69    40   0.15000  1.0 3.0
   48    42    69    62   3.97050  1.0 1.0
   48    42    69    70   0.15000  1.0 3.0
   48    42    69    40   0.56750  1.0 1.0
   48    42    69    40  -0.07550 -1.0 2.0
   48    42    69    40   0.20000  1.0 3.0
   48    55   -58    62   0.06250  1.0 1.0
   48    55   -58    62  -0.01100 -1.0 2.0
   48    55   -58    62   0.28050  1.0 3.0
   48    55    59    64   0.06250  1.0 1.0
   48    55    59    64  -0.01100 -1.0 2.0
   48    55    59    64   0.28050  1.0 3.0
   49    48    55    56   0.15000  1.0 3.0
   49    48    55    58   0.23400  1.0 3.0
   49    48    55    59   0.23400  1.0 3.0
   50    48    55    56   0.15000  1.0 3.0
   50    48    55    58   0.23400  1.0 3.0
   50    48    55    59   0.23400  1.0 3.0
   55    58    62    63   0.37050  1.0 3.0
   55    58    62    69   0.06250  1.0 1.0
   55    58    62    69  -0.01100 -1.0 2.0
   55    58    62    69   0.28050  1.0 3.0
   55    58    62    71  -0.81800  1.0 1.0
   55    59    64    65   0.37050  1.0 3.0
   55    59    64    66   0.37050  1.0 3.0
   55    59    64    72   0.06250  1.0 1.0
   55    59    64    72  -0.01100 -1.0 2.0
   55    59    64    72   0.28050  1.0 3.0
   56    55    58    62   0.37050  1.0 3.0
   56    55    59    64   0.37050  1.0 3.0
   58    55    59    64  -0.53350  1.0 1.0
   58    55    59    64  -0.78350 -1.0 2.0
   58    55    59    64   0.33750  1.0 3.0
   58    62   -69    42   0.62750  1.0 1.0
   58    62   -69    42  -0.30950 -1.0 2.0
   58    62   -69    42   0.27300  1.0 3.0
   58    62    69    70   0.23400  1.0 3.0
   58    62    69    40   0.62750  1.0 1.0
   58    62    69    40  -0.30950 -1.0 2.0
   58    62    69    40   0.27300  1.0 3.0
   58    62    71    77  -0.53350  1.0 1.0
   58    62    71    77  -0.78350 -1.0 2.0
   58    62    71    77   0.33750  1.0 3.0
   62    69    40    33   3.97050  1.0 1.0
   62    69    40    41   0.62750  1.0 1.0
   62    69    40    41  -0.30950 -1.0 2.0
   62    69    40    41   0.27300  1.0 3.0
   62    69    40    44   3.97050  1.0 1.0
   62    71    77    78   0.37050  1.0 3.0
   62    71    77    79   0.37050  1.0 3.0
   62    71    77    84   0.06250  1.0 1.0
   62    71    77    84  -0.01100 -1.0 2.0
   62    71    77    84   0.28050  1.0 3.0
   63    62    69    42   0.15000  1.0 3.0
   63    62    69    70   0.15000  1.0 3.0
   63    62    69    40   0.15000  1.0 3.0
   63    62    71    77   0.37050  1.0 3.0
   69    42    48    49   0.15000  1.0 3.0
   69    42    48    50   0.15000  1.0 3.0
   69    42   -48    55   3.97050  1.0 1.0
   69    62    71    77   0.06250  1.0 1.0
   69    62    71    77  -0.01100 -1.0 2.0
   69    62    71    77   0.28050  1.0 3.0
   69    40    44    45   0.15000  1.0 3.0
   69    40    44    46   0.15000  1.0 3.0
   69    40    44    51   0.86500  1.0 1.0
   69    40    44    51  -0.17500 -1.0 2.0
   69    40    44    51   0.20800  1.0 3.0
   70    69    40    33   0.15000  1.0 3.0
   70    69    40    41   0.23400  1.0 3.0
   70    69    40    44   0.15000  1.0 3.0
   40    33    38    39   0.15000  1.0 3.0
   40    33   -38    42   0.56750  1.0 1.0
   40    33   -38    42  -0.07550 -1.0 2.0
   40    33   -38    42   0.20000  1.0 3.0
   40    33    38    47   0.62750  1.0 1.0
   40    33    38    47  -0.30950 -1.0 2.0
   40    33    38    47   0.27300  1.0 3.0
   40    44    51    52  -0.11600  1.0 1.0
   40    44    51    52  -0.09450 -1.0 2.0
   40    44    51    52   0.21250  1.0 3.0
   41    40    44    45   0.23400  1.0 3.0
   41    40    44    46   0.23400  1.0 3.0
   41    40    44    51   3.69350  1.0 1.0
   41    40    44    51  -1.82950 -1.0 2.0
   45    44    51    52   0.19450  1.0 3.0
   46    44    51    52   0.19450  1.0 3.0
   71    62    69    42   0.62750  1.0 1.0
   71    62    69    42  -0.30950 -1.0 2.0
   71    62    69    42   0.27300  1.0 3.0
   71    62    69    70   0.23400  1.0 3.0
   71    62    69    40   0.62750  1.0 1.0
   71    62    69    40  -0.30950 -1.0 2.0
   71    62    69    40   0.27300  1.0 3.0
   71    77    84    85   0.23400  1.0 3.0
   71    77    84    86   0.23400  1.0 3.0
   71    77    84    87   0.23400  1.0 3.0
   78    77    84    85   0.15000  1.0 3.0
   78    77    84    86   0.15000  1.0 3.0
   78    77    84    87   0.15000  1.0 3.0
   79    77    84    85   0.15000  1.0 3.0
   79    77    84    86   0.15000  1.0 3.0
   79    77    84    87   0.15000  1.0 3.0
   59    55    58    62  -0.81800  1.0 1.0
   59    64    72    73   0.23400  1.0 3.0
   59    64    72    74   0.23400  1.0 3.0
   59    64    72    75   0.23400  1.0 3.0
   65    64    72    73   0.15000  1.0 3.0
   65    64    72    74   0.15000  1.0 3.0
   65    64    72    75   0.15000  1.0 3.0
   66    64    72    73   0.15000  1.0 3.0
   66    64    72    74   0.15000  1.0 3.0
   66    64    72    75   0.15000  1.0 3.0
   47    38    42    43   0.23400  1.0 3.0
   47    38    42    48   0.62750  1.0 1.0
   47    38    42    48  -0.30950 -1.0 2.0
   47    38    42    48   0.27300  1.0 3.0
   47    38    42    69   0.62750  1.0 1.0
   47    38    42    69  -0.30950 -1.0 2.0
   47    38    42    69   0.27300  1.0 3.0
   47    53    57    60   0.98750 -1.0 2.0
   47    53    57    88   0.98750 -1.0 2.0
   53    57    60    61   3.62500 -1.0 2.0
   53    57    60    67   3.62500 -1.0 2.0
   53    57    88    80   3.62500 -1.0 2.0
   53    57    88    89   3.62500 -1.0 2.0
   54    53    57    60   1.05000 -1.0 2.0
   54    53    57    88   1.05000 -1.0 2.0
   57    60    67    68   3.62500 -1.0 2.0
   57    60    67    76   3.62500 -1.0 2.0
   60    57    88    80   3.62500 -1.0 2.0
   60    57    88    89   3.62500 -1.0 2.0
   60    67   -76    80   3.62500 -1.0 2.0
   60    67    76    82   3.62500 -1.0 2.0
   61    60    67    68   3.62500 -1.0 2.0
   61    60    67    76   3.62500 -1.0 2.0
   67    76    80    81   3.62500 -1.0 2.0
   67    76    80    88   3.62500 -1.0 2.0
   67    76    82    83   0.84100 -1.0 2.0
   68    67    76    80   3.62500 -1.0 2.0
   68    67    76    82   3.62500 -1.0 2.0
   76    80   -88    57   3.62500 -1.0 2.0
   76    80    88    89   3.62500 -1.0 2.0
   80    76    82    83   0.84100 -1.0 2.0
   81    80    88    57   3.62500 -1.0 2.0
   81    80    88    89   3.62500 -1.0 2.0
   88    57    60    61   3.62500 -1.0 2.0
   88    57   -60    67   3.62500 -1.0 2.0
   82    76    80    81   3.62500 -1.0 2.0
   82    76    80    88   3.62500 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   47    57    53    54  10.50000 -1.0 2.0
   60    88    57    53   4.00000 -1.0 2.0
   67    61    60    57   1.10000 -1.0 2.0
   76    68    67    60   1.10000 -1.0 2.0
   80    82    76    67   4.00000 -1.0 2.0
   88    81    80    76   1.10000 -1.0 2.0
   80    89    88    57   1.10000 -1.0 2.0
END
