* LIGAND DATABASE FILE (OPLS2005)
*
001      63    63    112    157     319
    1     0 S   NP   _N1_     1    28.30548    95.38992   -22.98611
    2     1 S   H    _HN1     2     1.02957    80.84333    -0.32385
    3     1 S   H    _H1_     3     1.02835    29.72711   151.46626
    4     1 S   H    _H2_     4     1.02776   104.10503  -107.06701
    5     1 S   CT   _CA1     5     1.50133   135.03150   109.43017
    6     5 S   HC   _HA1     6     1.09575   105.21201    79.97589
    7     5 S   CO3  _C1_     7     1.53784   112.35834   -40.21159
    8     7 S   O2Z  _O11     8     1.26366   114.99510   -43.85536
    9     7 S   O2Z  _O12     9     1.26235   114.93236   135.22746
   10     5 S   CT   _CB1    10     1.53095   107.41959  -162.11416
   11    10 S   HC   HB11    11     1.09827   109.32916   -50.42460
   12    10 S   HC   HB12    12     1.09816   110.42804    66.12991
   13    10 S   CT   _CG1    13     1.53022   112.67817  -171.48871
   14    13 S   HC   HG11    14     1.09593   110.49954   -64.53464
   15    13 S   HC   HG12    15     1.09657   109.90883    54.66755
   16    13 S   C    _CD1    16     1.51846   112.30506   175.03951
   17    16 S   O    _OE1    17     1.22756   123.26888     0.90784
   18    16 S   N    _N2_    18     1.38547   111.71123  -179.09995
   19    18 S   H    _HN2    19     1.01558   119.06803     4.32291
   20    18 S   CT1  _CA2    20     1.45812   122.90266   177.93493
   21    20 S   HC   _HA2    21     1.09747   108.88320    24.46424
   22    20 S   C    _C2_    22     1.52946   107.28483   -92.41370
   23    22 S   O    _O2_    23     1.22971   123.11081   -25.93056
   24    20 S   CT   _CB2    32     1.53170   112.17179   147.63743
   25    24 S   HC   HB21    33     1.09535   110.18413    52.06450
   26    24 S   HC   HB22    34     1.09328   109.56281   170.98206
   27    22 S   N    _N3_    24     1.38558   112.47808   156.63079
   28    27 S   H    _HN3    25     1.01668   120.30342    -1.57719
   29    24 S   S    _SG2    35     1.82556   110.86079   -68.83664
   30    27 S   CT   _CA3    26     1.45322   122.51066   178.41168
   31    30 S   HC   HA31    27     1.09568   107.63693   -58.68664
   32    30 S   HC   HA32    28     1.09561   107.75909    57.62336
   33    29 S   CT   _C7_    36     1.85228   100.36661  -179.48490
   34    33 S   Cl   Cl1_    37     1.81894   105.60147  -174.47625
   35    30 S   CO3  _C3_    29     1.52893   114.36609   179.44715
   36    35 S   O2Z  _O31    30     1.26328   116.11100    -3.04543
   37    35 S   O2Z  _O32    31     1.26451   114.39660   177.02310
   38    33 S   NI   _N5_    38     1.45890   116.15061   -58.57994
   39    38 S   CDX  _C6_    39     1.29363   117.60243   109.44951
   40    39 S   NI   _N7_    40     1.37425   121.62494     0.43701
   41    39 S   NE   _N4_    55     1.37891   121.94972  -179.10256
   42    41 S   H    _H8_    56     1.01496   117.31127  -179.92087
   43    40 S   CDX  _C8_    41     1.29971   120.14531    11.80689
   44    41 S   CT   _C5_    57     1.44693   124.60784    -0.08156
   45    44 S   HC   _H6_    58     1.09546   109.82956   -59.62239
   46    44 S   HC   _H7_    59     1.09550   109.82539    59.09255
   47    33 S   NM   _N6_    42     1.45146   109.77827    74.75771
   48    43 S   NE   _N8_    43     1.37867   121.01628   178.68880
   49    48 S   H    _H9_    44     1.01621   115.62228     1.66448
   50    44 S   CT   _C4_    60     1.51846   110.27007   179.71745
   51    50 S   HC   _H3_    61     1.09521   111.01309   -59.92517
   52    50 S   HC   _H4_    62     1.09521   111.01590    59.96389
   53    50 S   HC   _H5_    63     1.09432   110.41746  -179.98022
   54    48 S   CT   _C9_    45     1.45640   128.38039   173.52828
   55    54 S   HC   _H10    46     1.09604   110.83591    34.56076
   56    54 S   CT   _C10    47     1.52597   109.53640   -86.38311
   57    56 S   HC   _H11    48     1.09578   111.30707   -57.73157
   58    56 S   HC   _H12    49     1.09485   111.13503    61.99110
   59    56 S   HC   _H13    50     1.09495   110.87282  -178.14903
   60    54 S   CT   _C11    51     1.52770   108.87980   152.64126
   61    60 S   HC   _H14    52     1.09590   111.49119    60.53122
   62    60 S   HC   _H15    53     1.09560   110.70267   -59.15264
   63    60 S   HC   _H16    54     1.09500   110.84996  -179.00653
  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   6   5   4   3
   8   4   2   1   1   7  10   8   9   4   7   6   5   4   3  11
   4   3   2   1   1   9   8   7   3   2   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    47    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    43    47  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    43    47    48    41  
   38    39    43    47  
   36    37  
   37  
    0  
   39    40    43    47    41    42    44  
   40    43    47    48    41    42    44    45    46    50  
   43    47    48    49    54    41    42    44  
   42    44    45    46    50    51    52    53    43  
   44    45    46    50  
   47    48    49    54    55    56    60  
   45    46    50    51    52    53  
   46    50    51    52    53  
   50    51    52    53  
   48    49    54  
   49    54    55    56    57    58    59    60    61    62    63  
   54    55    56    60  
   51    52    53  
   52    53  
   53  
    0  
   55    56    57    58    59    60    61    62    63  
   56    57    58    59    60    61    62    63  
   57    58    59    60    61    62    63  
   58    59    60  
   59    60  
   60  
   61    62    63  
   62    63  
   63  
    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  -0.175000   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   0.452500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   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   3.2800   0.1700  -0.481500   1.8540   1.6400   0.005000000   0.000000000
   39   3.7500   0.1050   0.693000   2.1120   1.8750   0.001000000  -0.126889456
   40   3.2800   0.1700  -0.718000   1.8540   1.6400   0.005000000   0.000000000
   41   3.2500   0.1700  -0.507500   1.8650   1.6500   0.051222218  -2.220205820
   42   0.5000   0.0300   0.410000   0.9960   0.8600   0.030040813  -0.651083722
   43   3.7500   0.1050   0.456500   2.1120   1.8750   0.001000000  -0.126889456
   44   3.5000   0.0660   0.002500   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.4200   0.1700  -1.245000   1.9310   1.7100   0.005000000   0.000000000
   48   3.2500   0.1700  -0.507500   1.8650   1.6500   0.051222218  -2.220205820
   49   0.5000   0.0300   0.410000   0.9960   0.8600   0.030040813  -0.651083722
   50   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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   245.000  1.781
   33    38   315.000  1.435
   33    47   320.000  1.444
   38    39   650.000  1.285
   39    40   630.000  1.388
   39    41   445.000  1.380
   40    43   650.000  1.285
   43    47   430.000  1.365
   43    48   445.000  1.380
   48    49   434.000  1.010
   48    54   382.000  1.448
   54    55   340.000  1.090
   54    56   268.000  1.529
   54    60   268.000  1.529
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   340.000  1.090
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   340.000  1.090
   41    42   434.000  1.010
   41    44   382.000  1.448
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    50   268.000  1.529
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   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    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    85.00000  110.65400
   29    33    38    75.00000  111.34000
   29    33    47    85.00000  109.00000
   33    38    39    75.00000  112.28000
   33    47    43    70.00000  118.22000
   38    33    34    85.00000  105.00000
   38    39    40    75.00000  130.08800
   38    39    41    75.00000  124.36500
   39    40    43    80.00000  112.53000
   39    41    42    35.00000  119.50000
   39    41    44    50.00000  119.50000
   40    43    47    75.00000  125.50000
   40    43    48    75.00000  124.36500
   43    48    49    35.00000  119.50000
   43    48    54    50.00000  119.50000
   47    33    34    85.00000  105.00000
   47    33    38    85.00000  109.00000
   48    43    47    80.00000  117.43000
   48    54    55    35.00000  109.50000
   48    54    56    80.00000  111.61500
   48    54    60    80.00000  111.61500
   54    48    49    35.00000  112.50000
   54    56    57    37.50000  110.70000
   54    56    58    37.50000  110.70000
   54    56    59    37.50000  110.70000
   54    60    61    37.50000  110.70000
   54    60    62    37.50000  110.70000
   54    60    63    37.50000  110.70000
   56    54    55    37.50000  110.70000
   58    56    57    33.00000  107.80000
   59    56    57    33.00000  107.80000
   59    56    58    33.00000  107.80000
   60    54    55    37.50000  110.70000
   60    54    56    58.35000  112.70000
   62    60    61    33.00000  107.80000
   63    60    61    33.00000  107.80000
   63    60    62    33.00000  107.80000
   41    39    40    75.00000  124.36500
   41    44    45    35.00000  109.50000
   41    44    46    35.00000  109.50000
   41    44    50    80.00000  111.61500
   44    41    42    35.00000  112.50000
   44    50    51    37.50000  110.70000
   44    50    52    37.50000  110.70000
   44    50    53    37.50000  110.70000
   46    44    45    33.00000  107.80000
   50    44    45    37.50000  110.70000
   50    44    46    37.50000  110.70000
   52    50    51    33.00000  107.80000
   53    50    51    33.00000  107.80000
   53    50    52    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    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   0.01700  1.0 1.0
   24    29    33    34  -0.23550 -1.0 2.0
   24    29    33    34   0.21350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    47   0.01700  1.0 1.0
   24    29    33    47  -0.23550 -1.0 2.0
   24    29    33    47   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  -0.12500  1.0 1.0
   29    33    38    39  -0.12500 -1.0 2.0
   29    33    38    39   0.25000  1.0 3.0
   29    33    47    43   0.00000  1.0 1.0
   33    38    39    40   6.00000 -1.0 2.0
   33    38    39    41   0.32050  1.0 1.0
   33    38    39    41   8.28000 -1.0 2.0
   34    33    38    39  -0.12500  1.0 1.0
   34    33    38    39  -0.12500 -1.0 2.0
   34    33    38    39   0.25000  1.0 3.0
   34    33    47    43   0.00000  1.0 1.0
   38    33    47    43   0.00000  1.0 1.0
   38    39   -40    43   0.00050  1.0 1.0
   38    39   -40    43   2.00000 -1.0 2.0
   38    39    41    42   1.50000 -1.0 2.0
   38    39    41    44  -0.86000  1.0 1.0
   38    39    41    44   0.84650 -1.0 2.0
   39    40    43    47   6.00000 -1.0 2.0
   39    40    43    48   6.00000 -1.0 2.0
   39    41    44    45   0.00000  1.0 1.0
   39    41    44    46   0.00000  1.0 1.0
   39    41    44    50   0.38950  1.0 1.0
   39    41    44    50  -0.47050 -1.0 2.0
   39    41    44    50   0.83150  1.0 3.0
   40    39    41    42   1.50000 -1.0 2.0
   40    39    41    44  -0.86000  1.0 1.0
   40    39    41    44   0.84650 -1.0 2.0
   40    43   -47    33   0.00000  1.0 1.0
   40    43    48    49   1.50000 -1.0 2.0
   40    43    48    54  -0.86000  1.0 1.0
   40    43    48    54   0.84650 -1.0 2.0
   43    48    54    55   0.00000  1.0 1.0
   43    48    54    56   0.38950  1.0 1.0
   43    48    54    56  -0.47050 -1.0 2.0
   43    48    54    56   0.83150  1.0 3.0
   43    48    54    60   0.38950  1.0 1.0
   43    48    54    60  -0.47050 -1.0 2.0
   43    48    54    60   0.83150  1.0 3.0
   47    33   -38    39  -0.12500  1.0 1.0
   47    33   -38    39  -0.12500 -1.0 2.0
   47    33   -38    39   0.25000  1.0 3.0
   47    43    48    49   1.00000 -1.0 2.0
   47    43    48    54   1.00000 -1.0 2.0
   48    43    47    33   0.00000  1.0 1.0
   48    54    56    57   0.22950  1.0 3.0
   48    54    56    58   0.22950  1.0 3.0
   48    54    56    59   0.22950  1.0 3.0
   48    54    60    61   0.22950  1.0 3.0
   48    54    60    62   0.22950  1.0 3.0
   48    54    60    63   0.22950  1.0 3.0
   49    48    54    55   0.00000  1.0 1.0
   49    48    54    56   0.00000  1.0 1.0
   49    48    54    60   0.00000  1.0 1.0
   55    54    56    57   0.15000  1.0 3.0
   55    54    56    58   0.15000  1.0 3.0
   55    54    56    59   0.15000  1.0 3.0
   55    54    60    61   0.15000  1.0 3.0
   55    54    60    62   0.15000  1.0 3.0
   55    54    60    63   0.15000  1.0 3.0
   56    54    60    61   0.15000  1.0 3.0
   56    54    60    62   0.15000  1.0 3.0
   56    54    60    63   0.15000  1.0 3.0
   60    54    56    57   0.15000  1.0 3.0
   60    54    56    58   0.15000  1.0 3.0
   60    54    56    59   0.15000  1.0 3.0
   41    39    40    43   0.00050  1.0 1.0
   41    39    40    43   2.00000 -1.0 2.0
   41    44    50    51   0.22950  1.0 3.0
   41    44    50    52   0.22950  1.0 3.0
   41    44    50    53   0.22950  1.0 3.0
   42    41    44    45   0.00000  1.0 1.0
   42    41    44    46   0.00000  1.0 1.0
   42    41    44    50   0.00000  1.0 1.0
   45    44    50    51   0.15000  1.0 3.0
   45    44    50    52   0.15000  1.0 3.0
   45    44    50    53   0.15000  1.0 3.0
   46    44    50    51   0.15000  1.0 3.0
   46    44    50    52   0.15000  1.0 3.0
   46    44    50    53   0.15000  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
   36    30    35    37  10.50000 -1.0 2.0
   40    41    39    38  10.50000 -1.0 2.0
   47    48    43    40  10.50000 -1.0 2.0
   49    43    48    54   1.00000 -1.0 2.0
   42    39    41    44   1.00000 -1.0 2.0
END
