* LIGAND DATABASE FILE (OPLS2005)
*
001      57    58    100    161     296
    1     0 S   NP   _N1_     1    28.72708    96.13224   -23.37400
    2     1 S   H    _HN1     2     1.02950    74.87604    12.39063
    3     1 S   H    _H1_     3     1.02829    35.80679   165.86355
    4     1 S   H    _H2_     4     1.02784   104.22060   -93.16372
    5     1 S   CT   _CA1     5     1.50114   138.34801   116.23889
    6     5 S   HC   _HA1     6     1.09573   105.20238    87.70637
    7     5 S   CO3  _C1_     7     1.53787   112.44187   -32.53688
    8     7 S   O2Z  _O11     8     1.26371   115.00377   -42.93358
    9     7 S   O2Z  _O12     9     1.26237   114.94355   136.19457
   10     5 S   CT   _CB1    10     1.53079   107.42053  -154.31457
   11    10 S   HC   HB11    11     1.09832   109.37766   -49.81310
   12    10 S   HC   HB12    12     1.09813   110.44453    66.79330
   13    10 S   CT   _CG1    13     1.52988   112.60429  -170.79867
   14    13 S   HC   HG11    14     1.09584   110.61412   -65.32127
   15    13 S   HC   HG12    15     1.09669   109.80723    53.91048
   16    13 S   C    _CD1    16     1.51799   112.23991   174.35937
   17    16 S   O    _OE1    17     1.22730   123.28997     6.03761
   18    16 S   N    _N2_    18     1.38638   111.65790  -174.06509
   19    18 S   H    _HN2    19     1.01584   118.95848     1.63075
   20    18 S   CT1  _CA2    20     1.46238   123.41793   177.76157
   21    20 S   HC   _HA2    21     1.09738   109.37968     1.80689
   22    20 S   C    _C2_    22     1.53549   108.48853  -113.63468
   23    22 S   O    _O2_    23     1.23036   122.35135  -147.70262
   24    20 S   CT   _CB2    32     1.53481   111.53896   123.81425
   25    24 S   HC   HB21    33     1.09442   109.44258    56.57571
   26    24 S   HC   HB22    34     1.09396   109.69258   175.50869
   27    22 S   N    _N3_    24     1.38359   113.66253    39.75555
   28    27 S   H    _HN3    25     1.01583   119.57229    -3.36912
   29    24 S   S    _SG2    35     1.83296   110.94001   -64.56523
   30    27 S   CT   _CA3    26     1.45283   123.19282   177.11805
   31    30 S   HC   HA31    27     1.09549   107.51058   -64.55461
   32    30 S   HC   HA32    28     1.09557   107.98538    51.88359
   33    29 S   CT   _C9_    36     1.87867   102.13963   176.36563
   34    30 S   CO3  _C3_    29     1.52956   114.08315   173.87580
   35    34 S   O2Z  _O31    30     1.26376   116.06295    -0.80113
   36    34 S   O2Z  _O32    31     1.26428   114.41395   179.26246
   37    33 S   CM   _C10    37     1.50241   106.97530    62.00516
   38    37 S   HC   _H5_    38     1.09248   115.13491    65.38385
   39    33 S   CM   _C5_    47     1.54673   112.40736  -176.51732
   40    37 S   CMA  _C11    39     1.34730   127.88148  -114.85989
   41    40 S   OM   _O38    40     1.26221   128.74130  -179.97202
   42    39 S   CM   _C4_    48     1.34451   125.78967    -5.65447
   43    42 S   HC   _H3_    49     1.08347   122.89183    -0.24066
   44    40 S   C    _C12    41     1.51576   115.75308     0.30519
   45    44 S   O    _O36    42     1.23301   122.24043   178.81024
   46    42 S   CO4  _C8_    50     1.47215   123.60175  -179.83449
   47    46 S   O    _O34    51     1.22188   122.36382   179.94766
   48    44 S   N    _N5_    43     1.38531   117.57025    -1.24741
   49    48 S   H    _H6_    44     1.01465   115.22603  -178.88706
   50    46 S   C    _C7_    52     1.49528   118.43921     0.05234
   51    50 S   O    _O33    53     1.22171   119.48339  -179.88465
   52    33 S   C    _C13    45     1.52941   105.64971   -59.87816
   53    52 S   O    _O37    46     1.23263   122.83188   -65.11702
   54    50 S   N    _N4_    54     1.37636   114.75643     0.10279
   55    54 S   H    _H4_    55     1.01524   116.13178   179.96044
   56    39 S   C    _C6_    56     1.50961   116.40188   174.56001
   57    56 S   O    _O35    57     1.22931   121.92475    -0.51964
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  16   2   1   1  11   5  13   6   3   9   4   5   3   6   3   3
   2   5   3   2   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    52    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    40    48    52    53    39    42    56  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    40    41    44    48    49    52    53    39    42    43    46    54    56    57  
   35    36  
   36  
    0  
   38    40    41    44    45    48    52    53    39    42    56  
   40    41    44    52    39  
   42    43    46    47    50    54    55    56    57    40    48    52    53  
   41    44    45    48    49    52  
   44    45    48  
   43    46    47    50    51    54    56    57    52  
   46    47    50    56  
   45    48    49    52    53  
   48    49    52  
   47    50    51    54    55    56  
   50    51    54  
   49    52    53  
   52    53  
   51    54    55    56    57  
   54    55    56  
   53    56  
    0  
   55    56    57  
   56    57  
   57  
    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   0.007500   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   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   43   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   44   3.7500   0.1050   0.570500   1.9250   1.7000   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.508000   1.5250   1.4250   0.001000000  -1.480495490
   46   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   47   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   48   3.2500   0.1700  -0.481700   1.8100   1.6000   0.054801302  -1.445846770
   49   0.5000   0.0300   0.356700   1.5900   1.4000   0.030040813  -0.651083722
   50   3.7500   0.1050   0.570500   1.9250   1.7000   0.001000000  -0.126889456
   51   2.9600   0.2100  -0.508000   1.5250   1.4250   0.001000000  -1.480495490
   52   3.7500   0.1050   0.570500   1.9250   1.7000   0.001000000  -0.126889456
   53   2.9600   0.2100  -0.508000   1.5250   1.4250   0.001000000  -1.480495490
   54   3.2500   0.1700  -0.481700   1.8100   1.6000   0.054801302  -1.445846770
   55   0.5000   0.0300   0.356700   1.5900   1.4000   0.030040813  -0.651083722
   56   3.7500   0.1050   0.570500   1.9250   1.7000   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.508000   1.5250   1.4250   0.001000000  -1.480495490
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   317.000  1.510
   33    52   317.000  1.522
   33    39   317.000  1.510
   37    38   340.000  1.080
   37    40   465.000  1.376
   40    41   745.000  1.250
   40    44   410.000  1.444
   44    45   570.000  1.229
   44    48   490.000  1.335
   48    49   434.000  1.010
   48    52   490.000  1.335
   52    53   570.000  1.229
   39    42   549.000  1.340
   39    56   410.000  1.444
   42    43   340.000  1.080
   42    46   320.000  1.462
   46    47   570.000  1.229
   46    50   250.000  1.524
   50    51   570.000  1.229
   50    54   490.000  1.335
   54    55   434.000  1.010
   54    56   490.000  1.335
   56    57   570.000  1.229
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  112.20000
   29    33    52    70.00000  112.33000
   29    33    39    75.00000  112.20000
   33    37    38    35.00000  117.00000
   33    37    40    70.00000  124.00000
   33    52    48    70.00000  116.60000
   33    52    53    80.00000  120.40000
   33    39    42    70.00000  124.00000
   33    39    56    70.00000  119.70000
   37    40    41    65.00000  137.10300
   37    40    44    70.00000  118.70000
   40    37    38    40.00000  120.50800
   40    44    45    80.00000  125.30000
   40    44    48    80.00000  111.56200
   44    40    41    65.00000  121.00000
   44    48    49    35.00000  119.80000
   44    48    52    70.00000  121.37400
   48    44    45    80.00000  122.90000
   48    52    53    80.00000  122.90000
   52    33    37    70.00000  115.00700
   52    48    49    35.00000  119.80000
   39    33    37    70.00000  110.12100
   39    33    52    70.00000  115.00700
   39    42    43    35.00000  120.00000
   39    42    46    65.00000  118.96000
   39    56    54    80.00000  111.56200
   39    56    57    80.00000  125.30000
   42    46    47    80.00000  123.72100
   42    46    50    65.00000  116.00000
   46    42    43    40.00000  117.72500
   46    50    51    75.00000  120.27800
   46    50    54    75.00000  110.04500
   50    46    47    80.00000  120.92000
   50    54    55    35.00000  119.80000
   50    54    56    70.00000  121.37400
   54    50    51    80.00000  122.90000
   54    56    57    80.00000  122.90000
   56    39    42    70.00000  118.70000
   56    54    55    35.00000  119.80000
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  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  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  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  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   0.00000  1.0 1.0
   29    33    37    40   0.42700  1.0 1.0
   29    33    37    40  -0.70350 -1.0 2.0
   29    33    37    40  -0.43150  1.0 3.0
   29    33    52    48   0.00000  1.0 1.0
   29    33    52    53   0.30150 -1.0 2.0
   29    33    39    42   0.42700  1.0 1.0
   29    33    39    42  -0.70350 -1.0 2.0
   29    33    39    42  -0.43150  1.0 3.0
   29    33    39    56   0.09700  1.0 1.0
   29    33    39    56   0.15600 -1.0 2.0
   29    33    39    56  -0.50800  1.0 3.0
   33    37    40    41   7.00000 -1.0 2.0
   33    37    40    44   7.00000 -1.0 2.0
   33    39    42    43   7.00000 -1.0 2.0
   33    39    42    46   7.00000 -1.0 2.0
   33    39    56    54   1.59650  1.0 1.0
   33    39    56    54   0.42750 -1.0 2.0
   33    39    56    54  -0.48350  1.0 3.0
   33    39    56    57  -0.64400  1.0 1.0
   33    39    56    57   0.26850 -1.0 2.0
   37    33    52    48   0.00000  1.0 1.0
   37    33    52    53   0.30150 -1.0 2.0
   37    33    39    42  -0.28300  1.0 1.0
   37    33    39    42   0.26700 -1.0 2.0
   37    33    39    42  -0.63300  1.0 3.0
   37    33    39    56   0.09700  1.0 1.0
   37    33    39    56   0.15600 -1.0 2.0
   37    33    39    56  -0.50800  1.0 3.0
   37    40    44    45   1.00000 -1.0 2.0
   37    40   -44    48   0.49500  1.0 1.0
   37    40   -44    48   1.31600 -1.0 2.0
   37    40   -44    48  -0.02300  1.0 3.0
   38    37    40    41   7.00000 -1.0 2.0
   38    37    40    44   7.00000 -1.0 2.0
   40    44    48    49   2.56700 -1.0 2.0
   40    44    48    52   2.45000 -1.0 2.0
   41    40    44    45  -0.11900  1.0 1.0
   41    40    44    45   0.76850 -1.0 2.0
   41    40    44    45   0.14100  1.0 3.0
   41    40    44    48   1.50000 -1.0 2.0
   44    48   -52    33   2.45000 -1.0 2.0
   44    48    52    53   2.22250 -1.0 2.0
   45    44    48    49   2.45000 -1.0 2.0
   45    44    48    52   2.22250 -1.0 2.0
   49    48    52    33   2.45000 -1.0 2.0
   49    48    52    53   2.45000 -1.0 2.0
   52    33    37    38   0.00000  1.0 1.0
   52    33   -37    40  -0.51250  1.0 1.0
   52    33   -37    40  -0.88800 -1.0 2.0
   52    33   -37    40   0.08850  1.0 3.0
   52    33    39    42  -0.51250  1.0 1.0
   52    33    39    42  -0.88800 -1.0 2.0
   52    33    39    42   0.08850  1.0 3.0
   52    33    39    56   0.09700  1.0 1.0
   52    33    39    56   0.15600 -1.0 2.0
   52    33    39    56  -0.50800  1.0 3.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    40  -0.28300  1.0 1.0
   39    33    37    40   0.26700 -1.0 2.0
   39    33    37    40  -0.63300  1.0 3.0
   39    33    52    48   0.00000  1.0 1.0
   39    33    52    53   0.30150 -1.0 2.0
   39    42    46    47   1.00000 -1.0 2.0
   39    42    46    50   0.50400  1.0 1.0
   39    42    46    50   1.60000 -1.0 2.0
   39    42    46    50  -0.01800  1.0 3.0
   42    39    56    54   0.49500  1.0 1.0
   42    39    56    54   1.31600 -1.0 2.0
   42    39    56    54  -0.02300  1.0 3.0
   42    39    56    57   1.00000 -1.0 2.0
   42    46    50    51   0.03000  1.0 1.0
   42    46    50    51   0.58800 -1.0 2.0
   42    46    50    51   0.15550  1.0 3.0
   42    46   -50    54   0.43900  1.0 1.0
   42    46   -50    54  -0.18150 -1.0 2.0
   42    46   -50    54  -0.03650  1.0 3.0
   43    42    46    47   0.00000  1.0 1.0
   43    42    46    50   0.92800 -1.0 2.0
   46    50    54    55   2.56700 -1.0 2.0
   46    50    54    56   2.45000 -1.0 2.0
   47    46    50    51   0.06100 -1.0 2.0
   47    46    50    54   0.03000  1.0 1.0
   47    46    50    54   0.58800 -1.0 2.0
   47    46    50    54   0.15550  1.0 3.0
   50    54   -56    39   2.45000 -1.0 2.0
   50    54    56    57   2.22250 -1.0 2.0
   51    50    54    55   2.45000 -1.0 2.0
   51    50    54    56   2.22250 -1.0 2.0
   55    54    56    39   2.56700 -1.0 2.0
   55    54    56    57   2.45000 -1.0 2.0
   56    39    42    43   7.00000 -1.0 2.0
   56    39   -42    46   7.00000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    38    37    40   1.10000 -1.0 2.0
   44    41    40    37   1.10000 -1.0 2.0
   40    48    44    45  10.50000 -1.0 2.0
   49    44    48    52   1.00000 -1.0 2.0
   33    48    52    53  10.50000 -1.0 2.0
   33    56    39    42   1.10000 -1.0 2.0
   46    43    42    39   1.10000 -1.0 2.0
   42    50    46    47  10.50000 -1.0 2.0
   46    54    50    51  10.50000 -1.0 2.0
   55    50    54    56   1.00000 -1.0 2.0
   39    54    56    57  10.50000 -1.0 2.0
END
