* LIGAND DATABASE FILE (OPLS2005)
*
001      67    68    130    204     387
    1     0 S   NP   _N1_     1    28.73421    95.14839   -22.71215
    2     1 S   H    _HN1     2     1.02782    99.24022   -87.98617
    3     1 S   H    _H1_     3     1.02951    81.49369    19.35130
    4     1 S   H    _H2_     4     1.02830    31.83493   162.88663
    5     1 S   CT   _CA1     5     1.50104   139.41807   130.92114
    6     5 S   HC   _HA1     6     1.09572   105.23245    76.60920
    7     5 S   CO3  _C1_     7     1.53801   112.37863   -43.67834
    8     7 S   O2Z  _O11     8     1.26373   115.01187   -44.50195
    9     7 S   O2Z  _O12     9     1.26236   114.94075   134.66974
   10     5 S   CT   _CB1    10     1.53088   107.43453  -165.40982
   11    10 S   HC   HB11    11     1.09829   109.43182   -49.95444
   12    10 S   HC   HB12    12     1.09815   110.42237    66.65376
   13    10 S   CT   _CG1    13     1.52990   112.58288  -170.94887
   14    13 S   HC   HG11    14     1.09589   110.57412   -63.82251
   15    13 S   HC   HG12    15     1.09664   109.86410    55.40668
   16    13 S   C    _CD1    16     1.51793   112.27002   175.87954
   17    16 S   O    _OE1    17     1.22736   123.31227     3.65420
   18    16 S   N    _N2_    18     1.38649   111.64726  -176.59171
   19    18 S   H    _HN2    19     1.01599   118.98537     1.65706
   20    18 S   CT1  _CA2    20     1.46159   123.32511   178.54236
   21    20 S   HC   _HA2    21     1.09746   109.34270    -3.36744
   22    20 S   C    _C2_    22     1.53479   108.62141  -118.79710
   23    22 S   O    _O2_    23     1.23047   122.27803  -148.75800
   24    20 S   CT   _CB2    32     1.53514   111.71903   118.55118
   25    24 S   HC   HB21    33     1.09553   109.57634    55.91783
   26    24 S   HC   HB22    34     1.09212   109.62262   174.71168
   27    22 S   N    _N3_    24     1.38330   113.61311    38.77074
   28    27 S   H    _HN3    25     1.01618   119.54395    -3.64986
   29    24 S   S    _SG2    35     1.82844   111.19600   -64.03976
   30    27 S   CT   _CA3    26     1.45289   123.16070   176.96668
   31    30 S   HC   HA31    27     1.09550   107.52976   -63.84258
   32    30 S   HC   HA32    28     1.09557   107.94915    52.57451
   33    29 S   CT   _C9_    36     1.88491   103.51349  -163.53608
   34    30 S   CO3  _C3_    29     1.52944   114.11602   174.55579
   35    34 S   O2Z  _O31    30     1.26370   116.05861    -0.70942
   36    34 S   O2Z  _O32    31     1.26429   114.41269   179.34958
   37    33 S   CT   _C10    37     1.53957   112.17607   -39.78822
   38    37 S   HC   _H14    38     1.09622   111.20799   166.86507
   39    37 S   HC   _H15    39     1.08893   115.66034    42.54119
   40    33 S   CT   _C5_    54     1.55096   111.64251    92.34080
   41    40 S   HC   _H3_    55     1.10028   107.50864   179.59652
   42    37 S   CO4  _C11    40     1.52045   102.00752   -78.79385
   43    42 S   O    _O33    41     1.22427   123.54404   164.05833
   44    40 S   CT   _C4_    56     1.52887   114.87504   -63.04779
   45    44 S   HC   _H7_    57     1.09406   112.16577    69.88207
   46    44 S   HC   _H8_    58     1.09433   111.17016   -52.20885
   47    44 S   HC   _H9_    59     1.09590   110.15399  -171.04689
   48    42 S   CT   _C12    42     1.52410   112.07684   -17.03071
   49    48 S   HC   _H6_    43     1.09476   108.91304   105.43105
   50    33 S   CT   _C8_    44     1.55726   110.11530  -149.82692
   51    50 S   HC   _H5_    45     1.10432   107.57229  -176.44455
   52    48 S   CT   _C13    64     1.51767   112.31640  -131.98023
   53    52 S   HC   _H16    65     1.09555   111.57037    53.66269
   54    52 S   HC   _H17    66     1.09529   110.53386   -65.48630
   55    52 S   HC   _H18    67     1.09423   111.05054   174.63480
   56    50 S   CT   _C7_    46     1.51950   113.41354   -59.57659
   57    56 S   HC   _H12    47     1.09370   114.29548    60.41794
   58    56 S   HC   _H13    48     1.09505   111.02145  -175.77362
   59    56 S   NP   _N4_    49     1.52162   107.48215   -59.40870
   60    59 S   H    _H4_    50     1.02937   106.70561   -62.79903
   61    59 S   CT   _C6_    51     1.51921   114.34798    54.66430
   62    61 S   HC   _H10    52     1.09609   106.42499  -173.81826
   63    61 S   HC   _H11    53     1.09507   107.49688    69.98565
   64    59 S   CT   _C14    60     1.50516   111.26798  -178.05137
   65    64 S   HC   _H19    61     1.09319   108.58518   -64.34062
   66    64 S   HC   _H20    62     1.09310   108.05258    56.20375
   67    64 S   HC   _H21    63     1.09309   108.06936   175.09152
  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
  23   2   1   1  14   6   5  16   9  10   4   8   3   2   1  11
   7  12   5   4   2   1   1  11   5   4   8   7   6   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    50    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    42    48    50    51    56    61    40    41    44  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    42    43    48    49    50    51    56    57    58    59    61    62    63    40    41    44    45    46    47    52  
   35    36  
   36  
    0  
   38    39    42    43    48    49    50    51    56    61    40    41    44    52  
   39    42    43    48    50    40  
   42    43    48    50    40  
   41    44    45    46    47    64    42    48    50    51    56    59    60    61    62    63  
   44    45    46    47    50    59    61    62    63  
   43    48    49    50    51    56    52    53    54    55  
   48    49    50    52  
   45    46    47    50    59    61    62    63  
   46    47    61  
   47    61  
   61  
   49    50    51    56    57    58    59    52    53    54    55  
   50    51    56    52    53    54    55  
   51    56    57    58    59    60    61    64    52    53    54    55  
   56    57    58    59    52  
   53    54    55    56  
   54    55  
   55  
    0  
   57    58    59    60    61    62    63    64    65    66    67  
   58    59    60    61    64  
   59    60    61    64  
   60    61    62    63    64    65    66    67  
   61    62    63    64    65    66    67  
   62    63    64    65    66    67  
   63    64  
   64  
   65    66    67  
   66    67  
   67  
    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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   42   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   44   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.4200   0.0150   0.060000   1.6450   1.4500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   59   3.2500   0.1700  -0.100000   2.1950   1.9500   0.003973653   1.685851020
   60   0.5000   0.0300   0.290000   0.9960   0.8600   0.030040813  -0.651083722
   61   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   64   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.6450   1.4500   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    50   268.000  1.529
   33    40   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    42   317.000  1.522
   42    43   570.000  1.229
   42    48   317.000  1.522
   48    49   340.000  1.090
   48    50   268.000  1.529
   48    52   268.000  1.529
   50    51   340.000  1.090
   50    56   268.000  1.529
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   367.000  1.471
   59    60   434.000  1.010
   59    61   367.000  1.471
   59    64   367.000  1.471
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    40   268.000  1.529
   40    41   340.000  1.090
   40    44   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   340.000  1.090
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   340.000  1.090
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   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    50    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    42    63.00000  111.10000
   33    50    48    58.35000  112.70000
   33    50    51    37.50000  110.70000
   33    50    56    58.35000  112.70000
   33    40    61    58.35000  112.70000
   33    40    41    37.50000  110.70000
   33    40    44    58.35000  112.70000
   37    42    43    80.00000  120.40000
   37    42    48    70.00000  116.00000
   39    37    38    33.00000  107.80000
   42    37    38    35.00000  109.50000
   42    37    39    35.00000  109.50000
   42    48    49    35.00000  109.50000
   42    48    50    63.00000  111.10000
   42    48    52    63.00000  111.10000
   48    42    43    80.00000  120.40000
   48    50    51    37.50000  110.70000
   48    50    56    58.35000  112.70000
   48    52    53    37.50000  110.70000
   48    52    54    37.50000  110.70000
   48    52    55    37.50000  110.70000
   50    33    37    58.35000  112.70000
   50    48    49    37.50000  110.70000
   50    56    57    37.50000  110.70000
   50    56    58    37.50000  110.70000
   50    56    59    80.00000  111.20000
   56    50    51    37.50000  110.70000
   56    59    60    35.00000  109.50000
   56    59    61    75.00000  113.01200
   56    59    64    75.00000  113.01200
   58    56    57    33.00000  107.80000
   59    56    57    35.00000  109.50000
   59    56    58    35.00000  109.50000
   59    61    62    35.00000  109.50000
   59    61    63    35.00000  109.50000
   59    61    40    80.00000  111.20000
   59    64    65    35.00000  109.50000
   59    64    66    35.00000  109.50000
   59    64    67    35.00000  109.50000
   61    59    60    35.00000  109.50000
   61    40    41    37.50000  110.70000
   61    40    44    58.35000  112.70000
   63    61    62    33.00000  107.80000
   40    33    37    58.35000  112.70000
   40    33    50    58.35000  112.70000
   40    61    62    37.50000  110.70000
   40    61    63    37.50000  110.70000
   40    44    45    37.50000  110.70000
   40    44    46    37.50000  110.70000
   40    44    47    37.50000  110.70000
   44    40    41    37.50000  110.70000
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    33.00000  107.80000
   64    59    60    35.00000  109.50000
   64    59    61    75.00000  113.01200
   66    64    65    33.00000  107.80000
   67    64    65    33.00000  107.80000
   67    64    66    33.00000  107.80000
   52    48    49    37.50000  110.70000
   52    48    50    58.35000  112.70000
   54    52    53    33.00000  107.80000
   55    52    53    33.00000  107.80000
   55    52    54    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    50   0.01700  1.0 1.0
   24    29    33    50  -0.23550 -1.0 2.0
   24    29    33    50   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    37    38   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    42   0.56750  1.0 1.0
   29    33    37    42  -0.07550 -1.0 2.0
   29    33    37    42   0.20000  1.0 3.0
   29    33    50    48   0.44750  1.0 1.0
   29    33    50    48  -0.17800 -1.0 2.0
   29    33    50    48   0.20200  1.0 3.0
   29    33    50    51   0.15000  1.0 3.0
   29    33    50    56   0.44750  1.0 1.0
   29    33    50    56  -0.17800 -1.0 2.0
   29    33    50    56   0.20200  1.0 3.0
   29    33    40    61   0.44750  1.0 1.0
   29    33    40    61  -0.17800 -1.0 2.0
   29    33    40    61   0.20200  1.0 3.0
   29    33    40    41   0.15000  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    37    42    43   0.30150 -1.0 2.0
   33    37   -42    48   0.60050  1.0 1.0
   33    37   -42    48   0.05600 -1.0 2.0
   33    37   -42    48   0.26150  1.0 3.0
   33    50    56    57   0.15000  1.0 3.0
   33    50    56    58   0.15000  1.0 3.0
   33    50    56    59   1.36600  1.0 1.0
   33    50    56    59  -0.11450 -1.0 2.0
   33    50    56    59   0.24250  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    47   0.15000  1.0 3.0
   37    33   -50    48   0.56750  1.0 1.0
   37    33   -50    48  -0.07550 -1.0 2.0
   37    33   -50    48   0.20000  1.0 3.0
   37    33    50    51   0.15000  1.0 3.0
   37    33    50    56   0.56750  1.0 1.0
   37    33    50    56  -0.07550 -1.0 2.0
   37    33    50    56   0.20000  1.0 3.0
   37    33    40    61   0.56750  1.0 1.0
   37    33    40    61  -0.07550 -1.0 2.0
   37    33    40    61   0.20000  1.0 3.0
   37    33    40    41   0.15000  1.0 3.0
   37    33    40    44   0.56750  1.0 1.0
   37    33    40    44  -0.07550 -1.0 2.0
   37    33    40    44   0.20000  1.0 3.0
   37    42    48    49   0.00000  1.0 1.0
   37    42   -48    50   0.60050  1.0 1.0
   37    42   -48    50   0.05600 -1.0 2.0
   37    42   -48    50   0.26150  1.0 3.0
   37    42    48    52   0.60050  1.0 1.0
   37    42    48    52   0.05600 -1.0 2.0
   37    42    48    52   0.26150  1.0 3.0
   38    37    42    43   0.00000  1.0 1.0
   38    37    42    48   0.00000  1.0 1.0
   39    37    42    43   0.00000  1.0 1.0
   39    37    42    48   0.00000  1.0 1.0
   42    48   -50    33  -0.95700  1.0 1.0
   42    48   -50    33  -0.18200 -1.0 2.0
   42    48   -50    33   0.29450  1.0 3.0
   42    48    50    51  -0.11250  1.0 3.0
   42    48    50    56  -0.95700  1.0 1.0
   42    48    50    56  -0.18200 -1.0 2.0
   42    48    50    56   0.29450  1.0 3.0
   42    48    52    53  -0.11250  1.0 3.0
   42    48    52    54  -0.11250  1.0 3.0
   42    48    52    55  -0.11250  1.0 3.0
   43    42    48    49   0.00000  1.0 1.0
   43    42    48    50   0.30150 -1.0 2.0
   43    42    48    52   0.30150 -1.0 2.0
   48    50    56    57   0.15000  1.0 3.0
   48    50    56    58   0.15000  1.0 3.0
   48    50    56    59   1.36600  1.0 1.0
   48    50    56    59  -0.11450 -1.0 2.0
   48    50    56    59   0.24250  1.0 3.0
   49    48    50    33   0.15000  1.0 3.0
   49    48    50    51   0.15000  1.0 3.0
   49    48    50    56   0.15000  1.0 3.0
   49    48    52    53   0.15000  1.0 3.0
   49    48    52    54   0.15000  1.0 3.0
   49    48    52    55   0.15000  1.0 3.0
   50    33    37    38   0.15000  1.0 3.0
   50    33    37    39   0.15000  1.0 3.0
   50    33   -37    42  -0.95700  1.0 1.0
   50    33   -37    42  -0.18200 -1.0 2.0
   50    33   -37    42   0.29450  1.0 3.0
   50    33    40    61   0.56750  1.0 1.0
   50    33    40    61  -0.07550 -1.0 2.0
   50    33    40    61   0.20000  1.0 3.0
   50    33    40    41   0.15000  1.0 3.0
   50    33    40    44   0.56750  1.0 1.0
   50    33    40    44  -0.07550 -1.0 2.0
   50    33    40    44   0.20000  1.0 3.0
   50    48    52    53   0.15000  1.0 3.0
   50    48    52    54   0.15000  1.0 3.0
   50    48    52    55   0.15000  1.0 3.0
   50    56    59    60   0.17350  1.0 3.0
   50    56   -59    61   0.47100  1.0 1.0
   50    56    59    64   0.47100  1.0 1.0
   51    50    56    57   0.15000  1.0 3.0
   51    50    56    58   0.15000  1.0 3.0
   51    50    56    59   0.19200  1.0 3.0
   56    59    61    62   0.15000  1.0 3.0
   56    59    61    63   0.15000  1.0 3.0
   56    59    61    40   0.47100  1.0 1.0
   56    59    64    65   0.15000  1.0 3.0
   56    59    64    66   0.15000  1.0 3.0
   56    59    64    67   0.15000  1.0 3.0
   57    56    59    60   0.13050  1.0 3.0
   57    56    59    61   0.15000  1.0 3.0
   57    56    59    64   0.15000  1.0 3.0
   58    56    59    60   0.13050  1.0 3.0
   58    56    59    61   0.15000  1.0 3.0
   58    56    59    64   0.15000  1.0 3.0
   59    61   -40    33   1.36600  1.0 1.0
   59    61   -40    33  -0.11450 -1.0 2.0
   59    61   -40    33   0.24250  1.0 3.0
   59    61    40    41   0.19200  1.0 3.0
   59    61    40    44   1.36600  1.0 1.0
   59    61    40    44  -0.11450 -1.0 2.0
   59    61    40    44   0.24250  1.0 3.0
   60    59    61    62   0.13050  1.0 3.0
   60    59    61    63   0.13050  1.0 3.0
   60    59    61    40   0.17350  1.0 3.0
   60    59    64    65   0.13050  1.0 3.0
   60    59    64    66   0.13050  1.0 3.0
   60    59    64    67   0.13050  1.0 3.0
   61    59    64    65   0.15000  1.0 3.0
   61    59    64    66   0.15000  1.0 3.0
   61    59    64    67   0.15000  1.0 3.0
   61    40    44    45   0.15000  1.0 3.0
   61    40    44    46   0.15000  1.0 3.0
   61    40    44    47   0.15000  1.0 3.0
   62    61    40    33   0.15000  1.0 3.0
   62    61    40    41   0.15000  1.0 3.0
   62    61    40    44   0.15000  1.0 3.0
   63    61    40    33   0.15000  1.0 3.0
   63    61    40    41   0.15000  1.0 3.0
   63    61    40    44   0.15000  1.0 3.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    42  -0.95700  1.0 1.0
   40    33    37    42  -0.18200 -1.0 2.0
   40    33    37    42   0.29450  1.0 3.0
   40    33    50    48   0.56750  1.0 1.0
   40    33    50    48  -0.07550 -1.0 2.0
   40    33    50    48   0.20000  1.0 3.0
   40    33    50    51   0.15000  1.0 3.0
   40    33   -50    56   0.56750  1.0 1.0
   40    33   -50    56  -0.07550 -1.0 2.0
   40    33   -50    56   0.20000  1.0 3.0
   41    40    44    45   0.15000  1.0 3.0
   41    40    44    46   0.15000  1.0 3.0
   41    40    44    47   0.15000  1.0 3.0
   64    59    61    62   0.15000  1.0 3.0
   64    59    61    63   0.15000  1.0 3.0
   64    59    61    40   0.47100  1.0 1.0
   52    48    50    33   0.56750  1.0 1.0
   52    48    50    33  -0.07550 -1.0 2.0
   52    48    50    33   0.20000  1.0 3.0
   52    48    50    51   0.15000  1.0 3.0
   52    48    50    56   0.56750  1.0 1.0
   52    48    50    56  -0.07550 -1.0 2.0
   52    48    50    56   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    48    42    43  10.50000 -1.0 2.0
END
