* LIGAND DATABASE FILE (OPLS2005)
*
001      59    59    102    154     299
    1     0 S   NP   _N1_     1    28.73530    95.91796   -19.41719
    2     1 S   H    _HN1     2     1.02958    79.54243     2.66712
    3     1 S   H    _H1_     3     1.02839    43.84750   130.90350
    4     1 S   H    _H2_     4     1.02774    85.32980  -107.05186
    5     1 S   CT   _CA1     5     1.50186   154.06679   118.11645
    6     5 S   HC   _HA1     6     1.09544   105.19958    68.79826
    7     5 S   CO3  _C1_     7     1.53871   112.51923   -51.55410
    8     7 S   O2Z  _O11     8     1.26383   114.95498   -33.67857
    9     7 S   O2Z  _O12     9     1.26243   115.21427   145.66024
   10     5 S   CT   _CB1    10     1.53140   107.45835  -172.69749
   11    10 S   HC   HB11    11     1.09827   109.84271   -43.66326
   12    10 S   HC   HB12    12     1.09817   110.19685    73.08200
   13    10 S   CT   _CG1    13     1.53017   112.60251  -164.43194
   14    13 S   HC   HG11    14     1.09481   110.75409   -61.17137
   15    13 S   HC   HG12    15     1.09651   109.73804    57.98382
   16    13 S   C    _CD1    16     1.51818   112.26891   178.80139
   17    16 S   O    _OE1    17     1.22761   123.23667     8.56376
   18    16 S   N    _N2_    18     1.38552   111.76442  -172.34758
   19    18 S   H    _HN2    19     1.01564   119.03063     6.92626
   20    18 S   CT1  _CA2    20     1.45563   122.88256  -179.86012
   21    20 S   HC   _HA2    21     1.09720   108.82196    24.68378
   22    20 S   C    _C2_    22     1.52977   106.68147   -92.18836
   23    22 S   O    _O2_    23     1.22970   122.87114   -29.13786
   24    20 S   CT   _CB2    32     1.53204   112.84065   147.98743
   25    24 S   HC   HB21    33     1.09598   111.55803    53.96350
   26    24 S   HC   HB22    34     1.09596   109.54845   171.44287
   27    22 S   N    _N3_    24     1.38611   112.48239   153.50839
   28    27 S   H    _HN3    25     1.01508   119.71463     1.53773
   29    24 S   S    _SG2    35     1.82706   113.08473   -70.31091
   30    27 S   CT   _CA3    26     1.45460   122.84231   176.33809
   31    30 S   HC   HA31    27     1.09539   108.97377    30.19793
   32    30 S   HC   HA32    28     1.09484   107.20507   147.25003
   33    29 S   CT   _C13    36     1.82046    99.89058    88.36492
   34    33 S   HC   _H3_    37     1.09188   109.49535   -68.00887
   35    33 S   HC   _H4_    38     1.09365   109.21921    49.74871
   36    30 S   CO3  _C3_    29     1.52993   113.34592   -92.98095
   37    36 S   O2Z  _O31    30     1.26390   115.58293   -38.93018
   38    36 S   O2Z  _O32    31     1.26376   114.86755   141.94951
   39    33 S   CM   _C9_    39     1.49319   110.33539   171.87979
   40    39 S   CMA  _C10    40     1.52084   122.55096   -92.21783
   41    40 S   OM   _O34    41     1.26312   121.12124   133.35316
   42    40 S   OM   _O13    42     1.26336   120.57147   -46.60522
   43    39 S   OS   _O16    43     1.38455   116.87668    76.17689
   44    43 S   CT   _C12    44     1.44181   111.89907   113.67049
   45    44 S   HC   _H22    45     1.09939   111.17477    19.96284
   46    44 S   CM   _C6_    46     1.51128   106.17978   136.03220
   47    46 S   HC   _H20    47     1.08735   116.01997   -68.25163
   48    46 S   CM   _C7_    48     1.34229   123.49460   110.93591
   49    48 S   CM   _C4_    49     1.44221   120.95918    -1.06735
   50    49 S   HC   _H18    50     1.08518   119.18357  -174.78970
   51    48 S   CO3  _C8_    57     1.54127   120.95288  -179.26087
   52    51 S   O2Z  _O33    58     1.26609   115.84182   -29.18624
   53    51 S   O2Z  _O14    59     1.26623   115.90055   151.04207
   54    49 S   CM   _C5_    51     1.33955   121.44797     6.37609
   55    54 S   HC   _H19    52     1.08594   119.14070   178.85790
   56    44 S   CT   _C11    53     1.55352   108.55200  -100.60484
   57    56 S   HC   _H21    54     1.09519   109.77024    17.12502
   58    56 S   OH   _O15    55     1.43074   108.77428   133.89177
   59    58 S   HO   _H25    56     0.97579   107.54004  -170.58362
  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   3   2   1   1   8   4   2   1   9  12   7  11   4   8
   9   4   3   1   1   5   3   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    43  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    44  
   35    39    40    43  
   39    40    43  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    56  
   41    42    43    44  
   42    43  
   43  
   44    45    46    47    48    54    56    57    58  
   45    46    47    48    49    54    55    56    57    58    59    51  
   46    47    48    54    56    57    58  
   47    48    49    50    54    56    57    58    51    52    53  
   48    49    56    51  
   49    50    54    55    56    51    52    53  
   50    54    55    56    57    58    51    52    53  
   54    55    56    51  
   52    53    54  
   53  
    0  
   55    56    57    58    59  
   56    57    58  
   57    58    59  
   58    59  
   59  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5500   0.0760  -0.516200   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0760   0.149000   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   42   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   43   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   44   3.5000   0.0660   0.239000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0760  -0.184000   2.0020   1.7750   0.023028004  -0.852763146
   47   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5500   0.0760  -0.310300   2.0020   1.7750   0.023028004  -0.852763146
   49   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   50   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   51   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   53   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   54   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   55   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   59   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    35   340.000  1.090
   33    39   317.000  1.510
   39    40   465.000  1.376
   39    43   440.000  1.360
   40    41   745.000  1.250
   40    42   745.000  1.250
   43    44   320.000  1.410
   44    45   340.000  1.090
   44    46   317.000  1.510
   44    56   268.000  1.529
   46    47   340.000  1.080
   46    48   549.000  1.340
   48    49   380.000  1.444
   48    51   230.000  1.545
   49    50   340.000  1.080
   49    54   549.000  1.340
   54    55   340.000  1.080
   54    56   317.000  1.510
   56    57   340.000  1.090
   56    58   320.000  1.410
   58    59   553.000  0.945
   51    52   656.000  1.250
   51    53   656.000  1.250
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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    35    35.00000  109.50000
   29    33    39    75.00000  112.20000
   33    39    40    70.00000  124.00000
   33    39    43    85.00000  112.85300
   35    33    34    33.00000  107.80000
   39    33    34    35.00000  109.50000
   39    33    35    35.00000  109.50000
   39    40    41    65.00000  137.10300
   39    40    42    65.00000  137.10300
   39    43    44    90.00000  111.18400
   42    40    41    65.00000  121.00000
   43    39    40    80.00000  120.01400
   43    44    45    35.00000  109.50000
   43    44    46    85.00000  110.90400
   43    44    56    50.00000  109.50000
   44    46    47    35.00000  117.00000
   44    46    48    70.00000  124.00000
   44    56    54    70.00000  112.02700
   44    56    57    37.50000  110.70000
   44    56    58    50.00000  109.50000
   46    44    45    35.00000  109.50000
   46    48    49    70.00000  123.01800
   46    48    51    55.00000  124.75400
   48    46    47    35.00000  120.00000
   48    49    50    35.00000  120.00000
   48    49    54    70.00000  123.01800
   48    51    52    85.00000  113.83300
   48    51    53    85.00000  113.83300
   49    54    55    35.00000  120.00000
   49    54    56    70.00000  124.00000
   54    49    50    35.00000  120.00000
   54    56    57    35.00000  109.50000
   54    56    58    90.00000  110.39200
   56    44    45    37.50000  110.70000
   56    44    46    70.00000  112.02700
   56    54    55    35.00000  117.00000
   56    58    59    55.00000  108.50000
   58    56    57    35.00000  109.50000
   51    48    49    55.00000  124.75400
   53    51    52    80.00000  126.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    35   0.32350  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    39    40   0.42700  1.0 1.0
   29    33    39    40  -0.70350 -1.0 2.0
   29    33    39    40  -0.43150  1.0 3.0
   29    33    39    43   0.09700  1.0 1.0
   29    33    39    43   0.15600 -1.0 2.0
   29    33    39    43  -0.50800  1.0 3.0
   33    39    40    41   7.00000 -1.0 2.0
   33    39    40    42   7.00000 -1.0 2.0
   33    39    43    44   2.00000 -1.0 2.0
   34    33    39    40   0.00000  1.0 1.0
   34    33    39    43   0.00000  1.0 1.0
   35    33    39    40   0.00000  1.0 1.0
   35    33    39    43   0.00000  1.0 1.0
   39    43    44    45   0.08050  1.0 3.0
   39    43    44    46  -0.48150  1.0 1.0
   39    43    44    46   0.09250 -1.0 2.0
   39    43    44    46  -0.12850  1.0 3.0
   39    43    44    56  -0.46850  1.0 1.0
   39    43    44    56   0.09300 -1.0 2.0
   39    43    44    56  -0.12850  1.0 3.0
   40    39    43    44  -2.26850  1.0 1.0
   40    39    43    44   3.39050 -1.0 2.0
   43    39    40    41   7.00000 -1.0 2.0
   43    39    40    42   7.00000 -1.0 2.0
   43    44    46    47   0.00000  1.0 1.0
   43    44    46    48   0.39000  1.0 1.0
   43    44    46    48  -0.05800 -1.0 2.0
   43    44    46    48  -0.55150  1.0 3.0
   43    44    56    54   0.61850  1.0 1.0
   43    44    56    54  -0.22750 -1.0 2.0
   43    44    56    54   0.15300  1.0 3.0
   43    44    56    57   0.23400  1.0 3.0
   43    44    56    58   3.69350  1.0 1.0
   43    44    56    58  -1.82950 -1.0 2.0
   44    46    48    49   7.00000 -1.0 2.0
   44    46    48    51   7.00000 -1.0 2.0
   44    56    58    59  -0.11600  1.0 1.0
   44    56    58    59  -0.09450 -1.0 2.0
   44    56    58    59   0.21250  1.0 3.0
   45    44    46    47   0.33100  1.0 3.0
   45    44    46    48   0.00000  1.0 1.0
   45    44    56    54   0.15000  1.0 3.0
   45    44    56    57   0.15000  1.0 3.0
   45    44    56    58   0.23400  1.0 3.0
   46    44    56    54   0.31000  1.0 1.0
   46    44    56    54   0.14700 -1.0 2.0
   46    44    56    54   0.07550  1.0 3.0
   46    44    56    57   0.15000  1.0 3.0
   46    44    56    58   1.05650  1.0 1.0
   46    44    56    58   0.15600 -1.0 2.0
   46    44    56    58   0.53150  1.0 3.0
   46    48    49    50  -0.18600  1.0 3.0
   46    48   -49    54   0.28850  1.0 1.0
   46    48   -49    54   2.61350 -1.0 2.0
   46    48   -49    54   0.78400  1.0 3.0
   46    48    51    52  -0.04000 -1.0 2.0
   46    48    51    52  -0.29050  1.0 3.0
   46    48    51    53  -0.04000 -1.0 2.0
   46    48    51    53  -0.29050  1.0 3.0
   47    46    48    49   7.00000 -1.0 2.0
   47    46    48    51   7.00000 -1.0 2.0
   48    49    54    55   7.00000 -1.0 2.0
   48    49    54    56   7.00000 -1.0 2.0
   49    48    51    52  -0.04000 -1.0 2.0
   49    48    51    52  -0.29050  1.0 3.0
   49    48    51    53  -0.04000 -1.0 2.0
   49    48    51    53  -0.29050  1.0 3.0
   49    54   -56    44   0.09850  1.0 1.0
   49    54   -56    44   0.15250 -1.0 2.0
   49    54   -56    44  -0.50650  1.0 3.0
   49    54    56    57   0.00000  1.0 1.0
   49    54    56    58   0.67800  1.0 1.0
   49    54    56    58   0.47050 -1.0 2.0
   49    54    56    58  -0.62500  1.0 3.0
   50    49    54    55   7.00000 -1.0 2.0
   50    49    54    56   7.00000 -1.0 2.0
   54    56    58    59  -0.07800  1.0 1.0
   54    56    58    59  -0.21500 -1.0 2.0
   54    56    58    59  -0.03150  1.0 3.0
   55    54    56    44   0.00000  1.0 1.0
   55    54    56    57   0.33100  1.0 3.0
   55    54    56    58   0.00000  1.0 1.0
   56    44    46    47   0.00000  1.0 1.0
   56    44   -46    48   0.09850  1.0 1.0
   56    44   -46    48   0.15250 -1.0 2.0
   56    44   -46    48  -0.50650  1.0 3.0
   57    56    58    59   0.19450  1.0 3.0
   51    48    49    50   0.00000  1.0 1.0
   51    48    49    54  -0.18600  1.0 3.0
IPHI
    9     5     7     8  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
   38    30    36    37  10.50000 -1.0 2.0
   33    43    39    40  15.00000 -1.0 2.0
   41    42    40    39  15.00000 -1.0 2.0
   44    47    46    48   1.10000 -1.0 2.0
   49    51    48    46   1.10000 -1.0 2.0
   48    50    49    54   1.10000 -1.0 2.0
   56    55    54    49   1.10000 -1.0 2.0
   52    48    51    53  10.50000 -1.0 2.0
END
