* LIGAND DATABASE FILE (OPLS2005)
*
001      75    77    147    237     443
    1     0 S   NP   _N1_     1    28.67517    96.04975   -23.83029
    2     1 S   H    _HN1     2     1.02784   106.66273   -84.75184
    3     1 S   H    _H1_     3     1.02949    72.80791    19.82111
    4     1 S   H    _H2_     4     1.02828    36.88283   177.46565
    5     1 S   CT   _CA1     5     1.50114   136.88755   121.55631
    6     5 S   HC   _HA1     6     1.09573   105.19707    91.36068
    7     5 S   CO3  _C1_     7     1.53777   112.41850   -28.87370
    8     7 S   O2Z  _O11     8     1.26372   115.00075   -43.44769
    9     7 S   O2Z  _O12     9     1.26233   114.93373   135.63101
   10     5 S   CT   _CB1    10     1.53071   107.41551  -150.67843
   11    10 S   HC   HB11    11     1.09834   109.35377   -49.85194
   12    10 S   HC   HB12    12     1.09813   110.46029    66.74321
   13    10 S   CT   _CG1    13     1.52996   112.61831  -170.83085
   14    13 S   HC   HG11    14     1.09585   110.63967   -65.79399
   15    13 S   HC   HG12    15     1.09669   109.79365    53.45189
   16    13 S   C    _CD1    16     1.51801   112.17296   173.88926
   17    16 S   O    _OE1    17     1.22737   123.27425     7.21996
   18    16 S   N    _N2_    18     1.38644   111.70249  -172.91978
   19    18 S   H    _HN2    19     1.01587   118.96166     1.54002
   20    18 S   CT1  _CA2    20     1.46212   123.35187   177.48962
   21    20 S   HC   _HA2    21     1.09743   109.38210     1.68028
   22    20 S   C    _C2_    22     1.53562   108.66552  -113.75660
   23    22 S   O    _O2_    23     1.23059   122.27825  -148.66160
   24    20 S   CT   _CB2    32     1.53486   111.52454   123.70990
   25    24 S   HC   HB21    33     1.09307   109.41312    57.11990
   26    24 S   HC   HB22    34     1.09315   109.47247   175.42384
   27    22 S   N    _N3_    24     1.38328   113.70382    38.85672
   28    27 S   H    _HN3    25     1.01589   119.57665    -3.48554
   29    24 S   S    _SG2    35     1.83057   110.87557   -65.21368
   30    27 S   CT   _CA3    26     1.45284   123.20942   177.06408
   31    30 S   HC   HA31    27     1.09549   107.52322   -64.20224
   32    30 S   HC   HA32    28     1.09556   107.96751    52.23071
   33    29 S   CT   _C13    36     1.88351   102.81469   166.25598
   34    30 S   CO3  _C3_    29     1.52957   114.08637   174.21704
   35    34 S   O2Z  _O31    30     1.26377   116.07270    -0.64133
   36    34 S   O2Z  _O32    31     1.26430   114.41233   179.41650
   37    33 S   CT   _C17    37     1.57195   107.85345   -69.80570
   38    37 S   HC   _H9_    38     1.09290   112.77697    36.58114
   39    33 S   CT   _C12    64     1.55573   113.01809    57.34299
   40    39 S   HC   _H7_    65     1.09503   106.67916   167.62331
   41    37 S   CO4  _C16    39     1.51627   102.06075   -79.76126
   42    41 S   O    _O35    40     1.22509   123.95607   163.25939
   43    39 S   OH   _O36    66     1.43433   109.06349   -78.63747
   44    43 S   HO   _H23    67     0.97189   108.28083  -170.96491
   45    37 S   CT   _C18    72     1.53023   116.71544   163.49843
   46    45 S   HC   _H20    73     1.09454   112.33243    51.70918
   47    45 S   HC   _H21    74     1.09287   111.79885   -70.27034
   48    45 S   HC   _H22    75     1.09632   110.36674   170.76488
   49    41 S   CT   _C15    41     1.50327   112.53658   -17.61720
   50    49 S   HC   _H18    42     1.09357   109.41867   111.75535
   51    49 S   HC   _H19    43     1.09335   109.71988  -126.76703
   52    33 S   CT   _C14    44     1.57290   109.50151  -178.96486
   53    52 S   HC   _H8_    45     1.10125   107.14709  -175.61523
   54    52 S   CT   _C5_    46     1.54562   119.28087   -55.57890
   55    54 S   HC   _H3_    47     1.09659   109.93603    61.19978
   56    54 S   CT   _C6_    48     1.53963   112.80604   -60.52661
   57    56 S   HC   _H13    49     1.09888   108.75533  -165.82784
   58    56 S   HC   _H14    50     1.09573   110.60023   -51.12228
   59    54 S   CT   _C4_    68     1.53978   110.62296   178.28856
   60    59 S   HC   _H10    69     1.09533   111.22647    58.11431
   61    59 S   HC   _H11    70     1.09429   111.50891   -62.90539
   62    59 S   HC   _H12    71     1.09561   110.87939   178.27172
   63    56 S   CT   _C7_    51     1.52302   113.55851    74.63409
   64    63 S   HC   _H4_    52     1.09560   109.06824    43.35920
   65    63 S   CT   _C8_    53     1.52067   117.70587   -82.93963
   66    65 S   HC   _H5_    54     1.10060   105.65374   153.64353
   67    65 S   CT   _C9_    55     1.53937   104.21424   -97.45181
   68    67 S   HC   _H6_    56     1.09656   109.15981  -138.03997
   69    67 S   CO4  _C10    57     1.50283   102.54685   -23.29547
   70    69 S   O    _O33    58     1.22183   125.36385  -166.27212
   71    67 S   CT   _C11    60     1.52261   117.69846    96.33815
   72    71 S   HC   _H15    61     1.09390   112.08482   -54.00636
   73    71 S   HC   _H16    62     1.09609   110.52194  -173.13259
   74    71 S   HC   _H17    63     1.09398   111.43271    67.87275
   75    63 S   OS   _O34    59     1.44089   108.72628   157.76890
  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
  25   2   1   1  17   9  19   7  11   5   6   1   5   2   1   1
   8   4   3  12   4  12   8  13   6   5   4   2   1   1   9   5
  10   5   8   7   6   2   4   2   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    52    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    49    52    53    54    65    39    40    43    45  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    49    50    51    52    53    54    55    56    63    65    66    67    39    40    43    44    59    45    46    47    48  
   35    36  
   36  
    0  
   38    41    42    49    50    51    52    53    54    65    39    40    43    45    46    47    48  
   41    42    49    52    39    45    46    47    48  
   40    43    44    45    41    49    52    53    54    56    63    64    65    66    67    68    69    71    75  
   43    44    52    63    65    66    67  
   42    49    50    51    52    53    54    45    46    47    48  
   49    50    51    52    45  
   44    52    63    65    66    67  
   65  
   46    47    48    49    52  
   47    48  
   48  
    0  
   50    51    52    53    54    55    56    59  
   51    52    53    54  
   52    53    54  
   53    54    55    56    57    58    63    65    59    60    61    62  
   54    55    56    59  
   55    56    57    58    63    64    65    75    59    60    61    62  
   56    57    58    63    59    60    61    62  
   57    58    63    64    65    66    67    69    75    59    60    61    62  
   58    63    64    65    75    59  
   63    64    65    75    59  
   60    61    62    63  
   61    62  
   62  
    0  
   64    65    66    67    68    69    70    75    71  
   65    66    67    69    75  
   66    67    68    69    70    75    71    72    73    74  
   67    68    69    75    71  
   68    69    70    75    71    72    73    74  
   69    70    75    71    72    73    74  
   70    75    71    72    73    74  
   75    71  
   72    73    74    75  
   73    74  
   74  
    0  
    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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   44   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   45   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   65   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   69   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   70   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   71   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
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    52   268.000  1.529
   33    39   268.000  1.529
   37    38   340.000  1.090
   37    41   317.000  1.522
   37    45   268.000  1.529
   41    42   570.000  1.229
   41    49   317.000  1.522
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   268.000  1.529
   52    53   340.000  1.090
   52    54   268.000  1.529
   54    55   340.000  1.090
   54    56   268.000  1.529
   54    59   268.000  1.529
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    63   268.000  1.529
   63    64   340.000  1.090
   63    65   268.000  1.529
   63    75   320.000  1.410
   65    66   340.000  1.090
   65    67   268.000  1.529
   65    39   268.000  1.529
   67    68   340.000  1.090
   67    69   317.000  1.522
   67    71   268.000  1.529
   69    70   570.000  1.229
   69    75   214.000  1.327
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   340.000  1.090
   39    40   340.000  1.090
   39    43   320.000  1.410
   43    44   553.000  0.945
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   340.000  1.090
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   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    52    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    41    63.00000  111.10000
   33    37    45    58.35000  112.70000
   33    52    49    58.35000  112.70000
   33    52    53    37.50000  110.70000
   33    52    54    58.35000  112.70000
   33    39    65    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    43    50.00000  109.50000
   37    41    42    80.00000  120.40000
   37    41    49    70.00000  116.00000
   37    45    46    37.50000  110.70000
   37    45    47    37.50000  110.70000
   37    45    48    37.50000  110.70000
   41    37    38    35.00000  109.50000
   41    49    50    35.00000  109.50000
   41    49    51    35.00000  109.50000
   41    49    52    63.00000  111.10000
   49    41    42    80.00000  120.40000
   49    52    53    37.50000  110.70000
   49    52    54    58.35000  112.70000
   51    49    50    33.00000  107.80000
   52    33    37    58.35000  112.70000
   52    49    50    37.50000  110.70000
   52    49    51    37.50000  110.70000
   52    54    55    37.50000  110.70000
   52    54    56    58.35000  112.70000
   52    54    59    58.35000  112.70000
   54    52    53    37.50000  110.70000
   54    56    57    37.50000  110.70000
   54    56    58    37.50000  110.70000
   54    56    63    58.35000  112.70000
   54    59    60    37.50000  110.70000
   54    59    61    37.50000  110.70000
   54    59    62    37.50000  110.70000
   56    54    55    37.50000  110.70000
   56    63    64    37.50000  110.70000
   56    63    65    58.35000  112.70000
   56    63    75    50.00000  109.50000
   58    56    57    33.00000  107.80000
   63    56    57    37.50000  110.70000
   63    56    58    37.50000  110.70000
   63    65    66    37.50000  110.70000
   63    65    67    58.35000  112.70000
   63    65    39    58.35000  112.70000
   63    75    69    83.00000  116.90000
   65    63    64    37.50000  110.70000
   65    67    68    37.50000  110.70000
   65    67    69    63.00000  111.10000
   65    67    71    58.35000  112.70000
   65    39    40    37.50000  110.70000
   65    39    43    50.00000  109.50000
   67    65    66    37.50000  110.70000
   67    69    70    80.00000  120.40000
   67    69    75    81.00000  111.40000
   67    71    72    37.50000  110.70000
   67    71    73    37.50000  110.70000
   67    71    74    37.50000  110.70000
   69    67    68    35.00000  109.50000
   75    63    64    35.00000  109.50000
   75    63    65    50.00000  109.50000
   75    69    70    83.00000  123.40000
   71    67    68    37.50000  110.70000
   71    67    69    63.00000  111.10000
   73    71    72    33.00000  107.80000
   74    71    72    33.00000  107.80000
   74    71    73    33.00000  107.80000
   39    33    37    58.35000  112.70000
   39    33    52    58.35000  112.70000
   39    65    66    37.50000  110.70000
   39    65    67    58.35000  112.70000
   39    43    44    55.00000  108.50000
   43    39    40    35.00000  109.50000
   59    54    55    37.50000  110.70000
   59    54    56    58.35000  112.70000
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    33.00000  107.80000
   45    37    38    37.50000  110.70000
   45    37    41    63.00000  111.10000
   47    45    46    33.00000  107.80000
   48    45    46    33.00000  107.80000
   48    45    47    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    52   0.01700  1.0 1.0
   24    29    33    52  -0.23550 -1.0 2.0
   24    29    33    52   0.21350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   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    38   0.15000  1.0 3.0
   29    33    37    41   0.56750  1.0 1.0
   29    33    37    41  -0.07550 -1.0 2.0
   29    33    37    41   0.20000  1.0 3.0
   29    33    37    45   0.44750  1.0 1.0
   29    33    37    45  -0.17800 -1.0 2.0
   29    33    37    45   0.20200  1.0 3.0
   29    33    52    49   0.44750  1.0 1.0
   29    33    52    49  -0.17800 -1.0 2.0
   29    33    52    49   0.20200  1.0 3.0
   29    33    52    53   0.15000  1.0 3.0
   29    33    52    54   0.44750  1.0 1.0
   29    33    52    54  -0.17800 -1.0 2.0
   29    33    52    54   0.20200  1.0 3.0
   29    33    39    65   0.44750  1.0 1.0
   29    33    39    65  -0.17800 -1.0 2.0
   29    33    39    65   0.20200  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    43   0.56750  1.0 1.0
   29    33    39    43  -0.07550 -1.0 2.0
   29    33    39    43   0.20000  1.0 3.0
   33    37    41    42   0.30150 -1.0 2.0
   33    37   -41    49   0.60050  1.0 1.0
   33    37   -41    49   0.05600 -1.0 2.0
   33    37   -41    49   0.26150  1.0 3.0
   33    37    45    46   0.15000  1.0 3.0
   33    37    45    47   0.15000  1.0 3.0
   33    37    45    48   0.15000  1.0 3.0
   33    52    54    55   0.15000  1.0 3.0
   33    52    54    56   0.56750  1.0 1.0
   33    52    54    56  -0.07550 -1.0 2.0
   33    52    54    56   0.20000  1.0 3.0
   33    52    54    59   0.56750  1.0 1.0
   33    52    54    59  -0.07550 -1.0 2.0
   33    52    54    59   0.20000  1.0 3.0
   33    39    43    44  -0.11600  1.0 1.0
   33    39    43    44  -0.09450 -1.0 2.0
   33    39    43    44   0.21250  1.0 3.0
   37    33   -52    49   0.56750  1.0 1.0
   37    33   -52    49  -0.07550 -1.0 2.0
   37    33   -52    49   0.20000  1.0 3.0
   37    33    52    53   0.15000  1.0 3.0
   37    33    52    54   0.56750  1.0 1.0
   37    33    52    54  -0.07550 -1.0 2.0
   37    33    52    54   0.20000  1.0 3.0
   37    33    39    65   0.56750  1.0 1.0
   37    33    39    65  -0.07550 -1.0 2.0
   37    33    39    65   0.20000  1.0 3.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    43   0.86500  1.0 1.0
   37    33    39    43  -0.17500 -1.0 2.0
   37    33    39    43   0.20800  1.0 3.0
   37    41    49    50   0.00000  1.0 1.0
   37    41    49    51   0.00000  1.0 1.0
   37    41   -49    52   0.60050  1.0 1.0
   37    41   -49    52   0.05600 -1.0 2.0
   37    41   -49    52   0.26150  1.0 3.0
   38    37    41    42   0.00000  1.0 1.0
   38    37    41    49   0.00000  1.0 1.0
   38    37    45    46   0.15000  1.0 3.0
   38    37    45    47   0.15000  1.0 3.0
   38    37    45    48   0.15000  1.0 3.0
   41    37    45    46  -0.11250  1.0 3.0
   41    37    45    47  -0.11250  1.0 3.0
   41    37    45    48  -0.11250  1.0 3.0
   41    49   -52    33  -0.95700  1.0 1.0
   41    49   -52    33  -0.18200 -1.0 2.0
   41    49   -52    33   0.29450  1.0 3.0
   41    49    52    53  -0.11250  1.0 3.0
   41    49    52    54  -0.95700  1.0 1.0
   41    49    52    54  -0.18200 -1.0 2.0
   41    49    52    54   0.29450  1.0 3.0
   42    41    49    50   0.00000  1.0 1.0
   42    41    49    51   0.00000  1.0 1.0
   42    41    49    52   0.30150 -1.0 2.0
   49    52    54    55   0.15000  1.0 3.0
   49    52    54    56   0.56750  1.0 1.0
   49    52    54    56  -0.07550 -1.0 2.0
   49    52    54    56   0.20000  1.0 3.0
   49    52    54    59   0.56750  1.0 1.0
   49    52    54    59  -0.07550 -1.0 2.0
   49    52    54    59   0.20000  1.0 3.0
   50    49    52    33   0.15000  1.0 3.0
   50    49    52    53   0.15000  1.0 3.0
   50    49    52    54   0.15000  1.0 3.0
   51    49    52    33   0.15000  1.0 3.0
   51    49    52    53   0.15000  1.0 3.0
   51    49    52    54   0.15000  1.0 3.0
   52    33    37    38   0.15000  1.0 3.0
   52    33   -37    41  -0.95700  1.0 1.0
   52    33   -37    41  -0.18200 -1.0 2.0
   52    33   -37    41   0.29450  1.0 3.0
   52    33    37    45   0.56750  1.0 1.0
   52    33    37    45  -0.07550 -1.0 2.0
   52    33    37    45   0.20000  1.0 3.0
   52    33    39    65   0.56750  1.0 1.0
   52    33    39    65  -0.07550 -1.0 2.0
   52    33    39    65   0.20000  1.0 3.0
   52    33    39    40   0.15000  1.0 3.0
   52    33    39    43   0.86500  1.0 1.0
   52    33    39    43  -0.17500 -1.0 2.0
   52    33    39    43   0.20800  1.0 3.0
   52    54    56    57   0.15000  1.0 3.0
   52    54    56    58   0.15000  1.0 3.0
   52    54    56    63   0.56750  1.0 1.0
   52    54    56    63  -0.07550 -1.0 2.0
   52    54    56    63   0.20000  1.0 3.0
   52    54    59    60   0.15000  1.0 3.0
   52    54    59    61   0.15000  1.0 3.0
   52    54    59    62   0.15000  1.0 3.0
   53    52    54    55   0.15000  1.0 3.0
   53    52    54    56   0.15000  1.0 3.0
   53    52    54    59   0.15000  1.0 3.0
   54    56    63    64   0.15000  1.0 3.0
   54    56    63    65   0.56750  1.0 1.0
   54    56    63    65  -0.07550 -1.0 2.0
   54    56    63    65   0.20000  1.0 3.0
   54    56    63    75   0.62750  1.0 1.0
   54    56    63    75  -0.30950 -1.0 2.0
   54    56    63    75   0.27300  1.0 3.0
   55    54    56    57   0.15000  1.0 3.0
   55    54    56    58   0.15000  1.0 3.0
   55    54    56    63   0.15000  1.0 3.0
   55    54    59    60   0.15000  1.0 3.0
   55    54    59    61   0.15000  1.0 3.0
   55    54    59    62   0.15000  1.0 3.0
   56    54    59    60   0.15000  1.0 3.0
   56    54    59    61   0.15000  1.0 3.0
   56    54    59    62   0.15000  1.0 3.0
   56    63    65    66   0.15000  1.0 3.0
   56    63    65    67   0.56750  1.0 1.0
   56    63    65    67  -0.07550 -1.0 2.0
   56    63    65    67   0.20000  1.0 3.0
   56    63    65    39   0.56750  1.0 1.0
   56    63    65    39  -0.07550 -1.0 2.0
   56    63    65    39   0.20000  1.0 3.0
   56    63    75    69  -0.25900  1.0 1.0
   56    63    75    69  -0.47000 -1.0 2.0
   56    63    75    69   0.11750  1.0 3.0
   57    56    63    64   0.15000  1.0 3.0
   57    56    63    65   0.15000  1.0 3.0
   57    56    63    75   0.23400  1.0 3.0
   58    56    63    64   0.15000  1.0 3.0
   58    56    63    65   0.15000  1.0 3.0
   58    56    63    75   0.23400  1.0 3.0
   63    65    67    68   0.15000  1.0 3.0
   63    65   -67    69  -0.95700  1.0 1.0
   63    65   -67    69  -0.18200 -1.0 2.0
   63    65   -67    69   0.29450  1.0 3.0
   63    65    67    71   0.56750  1.0 1.0
   63    65    67    71  -0.07550 -1.0 2.0
   63    65    67    71   0.20000  1.0 3.0
   63    65    39    33   0.56750  1.0 1.0
   63    65    39    33  -0.07550 -1.0 2.0
   63    65    39    33   0.20000  1.0 3.0
   63    65    39    40   0.15000  1.0 3.0
   63    65    39    43   0.86500  1.0 1.0
   63    65    39    43  -0.17500 -1.0 2.0
   63    65    39    43   0.20800  1.0 3.0
   64    63    65    66   0.15000  1.0 3.0
   64    63    65    67   0.15000  1.0 3.0
   64    63    65    39   0.15000  1.0 3.0
   64    63    75    69   0.08050  1.0 3.0
   65    63   -75    69  -0.25900  1.0 1.0
   65    63   -75    69  -0.47000 -1.0 2.0
   65    63   -75    69   0.11750  1.0 3.0
   65    67    69    70   0.30150 -1.0 2.0
   65    67   -69    75   0.36750  1.0 3.0
   65    67    71    72   0.15000  1.0 3.0
   65    67    71    73   0.15000  1.0 3.0
   65    67    71    74   0.15000  1.0 3.0
   65    39    43    44  -0.11600  1.0 1.0
   65    39    43    44  -0.09450 -1.0 2.0
   65    39    43    44   0.21250  1.0 3.0
   66    65    67    68   0.15000  1.0 3.0
   66    65    67    69  -0.11250  1.0 3.0
   66    65    67    71   0.15000  1.0 3.0
   66    65    39    33   0.15000  1.0 3.0
   66    65    39    40   0.15000  1.0 3.0
   66    65    39    43   0.23400  1.0 3.0
   67    65    39    33   0.56750  1.0 1.0
   67    65    39    33  -0.07550 -1.0 2.0
   67    65    39    33   0.20000  1.0 3.0
   67    65    39    40   0.15000  1.0 3.0
   67    65    39    43   0.86500  1.0 1.0
   67    65    39    43  -0.17500 -1.0 2.0
   67    65    39    43   0.20800  1.0 3.0
   67    69   -75    63   1.63150  1.0 1.0
   67    69   -75    63   2.92000 -1.0 2.0
   68    67    69    70   0.00000  1.0 1.0
   68    67    69    75   0.00000  1.0 1.0
   68    67    71    72   0.15000  1.0 3.0
   68    67    71    73   0.15000  1.0 3.0
   68    67    71    74   0.15000  1.0 3.0
   69    67    71    72  -0.11250  1.0 3.0
   69    67    71    73  -0.11250  1.0 3.0
   69    67    71    74  -0.11250  1.0 3.0
   70    69    75    63   3.00000 -1.0 2.0
   75    63    65    66   0.23400  1.0 3.0
   75    63   -65    67   0.62750  1.0 1.0
   75    63   -65    67  -0.30950 -1.0 2.0
   75    63   -65    67   0.27300  1.0 3.0
   75    63    65    39   0.62750  1.0 1.0
   75    63    65    39  -0.30950 -1.0 2.0
   75    63    65    39   0.27300  1.0 3.0
   71    67    69    70   0.30150 -1.0 2.0
   71    67    69    75   0.36750  1.0 3.0
   39    33    37    38   0.15000  1.0 3.0
   39    33    37    41  -0.95700  1.0 1.0
   39    33    37    41  -0.18200 -1.0 2.0
   39    33    37    41   0.29450  1.0 3.0
   39    33    37    45   0.56750  1.0 1.0
   39    33    37    45  -0.07550 -1.0 2.0
   39    33    37    45   0.20000  1.0 3.0
   39    33    52    49   0.56750  1.0 1.0
   39    33    52    49  -0.07550 -1.0 2.0
   39    33    52    49   0.20000  1.0 3.0
   39    33    52    53   0.15000  1.0 3.0
   39    33    52    54   0.56750  1.0 1.0
   39    33    52    54  -0.07550 -1.0 2.0
   39    33    52    54   0.20000  1.0 3.0
   39    65    67    68   0.15000  1.0 3.0
   39    65    67    69  -0.95700  1.0 1.0
   39    65    67    69  -0.18200 -1.0 2.0
   39    65    67    69   0.29450  1.0 3.0
   39    65    67    71   0.56750  1.0 1.0
   39    65    67    71  -0.07550 -1.0 2.0
   39    65    67    71   0.20000  1.0 3.0
   40    39    43    44   0.19450  1.0 3.0
   59    54    56    57   0.15000  1.0 3.0
   59    54    56    58   0.15000  1.0 3.0
   59    54    56    63   0.56750  1.0 1.0
   59    54    56    63  -0.07550 -1.0 2.0
   59    54    56    63   0.20000  1.0 3.0
   45    37    41    42   0.30150 -1.0 2.0
   45    37    41    49   0.60050  1.0 1.0
   45    37    41    49   0.05600 -1.0 2.0
   45    37    41    49   0.26150  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    49    41    42  10.50000 -1.0 2.0
   67    75    69    70  10.50000 -1.0 2.0
END
