* LIGAND DATABASE FILE (OPLS2005)
*
001      53    52     88    132     260
    1     0 S   NP   _N1_     1    28.22823    96.26275   -22.51290
    2     1 S   H    _HN1     2     1.02777   103.14553  -122.57980
    3     1 S   H    _H1_     3     1.02957    79.48291   -16.00441
    4     1 S   H    _H2_     4     1.02835    31.60006   134.56456
    5     1 S   CT   _CA1     5     1.50138   136.80947    92.65590
    6     5 S   HC   _HA1     6     1.09576   105.19869    81.15882
    7     5 S   CO3  _C1_     7     1.53776   112.35067   -38.99873
    8     7 S   O2Z  _O11     8     1.26367   114.99256   -43.90878
    9     7 S   O2Z  _O12     9     1.26234   114.92765   135.11438
   10     5 S   CT   _CB1    10     1.53089   107.41233  -160.95495
   11    10 S   HC   HB11    11     1.09829   109.29763   -50.45596
   12    10 S   HC   HB12    12     1.09815   110.44434    66.09055
   13    10 S   CT   _CG1    13     1.53026   112.69114  -171.51835
   14    13 S   HC   HG11    14     1.09593   110.50655   -65.11227
   15    13 S   HC   HG12    15     1.09659   109.89886    54.09259
   16    13 S   C    _CD1    16     1.51850   112.28318   174.44208
   17    16 S   O    _OE1    17     1.22758   123.26090     1.60937
   18    16 S   N    _N2_    18     1.38535   111.73348  -178.26788
   19    18 S   H    _HN2    19     1.01546   119.16874     3.36109
   20    18 S   CT1  _CA2    20     1.45908   122.86642   178.21864
   21    20 S   HC   _HA2    21     1.09708   108.87774    27.40063
   22    20 S   C    _C2_    22     1.52920   106.59166   -89.97947
   23    22 S   O    _O2_    23     1.23040   122.86545   -31.04043
   24    20 S   CT   _CB2    32     1.53259   112.31364   150.79103
   25    24 S   HC   HB21    33     1.09472   109.62300    56.59393
   26    24 S   HC   HB22    34     1.09422   109.54219   175.07375
   27    22 S   N    _N3_    24     1.38483   112.85302   151.60017
   28    27 S   H    _HN3    25     1.01688   120.35140    -0.96955
   29    24 S   S    _SG2    35     1.82717   110.94796   -64.54581
   30    27 S   CT   _CA3    26     1.45367   122.22631   178.65637
   31    30 S   HC   HA31    27     1.09575   107.36944   -64.00601
   32    30 S   HC   HA32    28     1.09574   107.97812    52.21731
   33    29 S   CT   _C10    36     1.84474   101.56722   173.08202
   34    30 S   CO3  _C3_    29     1.52838   114.63551   174.18540
   35    34 S   O2Z  _O31    30     1.26285   116.16757    -5.65447
   36    34 S   O2Z  _O32    31     1.26474   114.35327   174.51741
   37    33 S   CM   _C7_    37     1.52192   112.02732    58.89107
   38    33 S   CO3  _C9_    48     1.57985   106.82623   178.14248
   39    38 S   O2Z  _O33    49     1.27447   114.37302   161.99639
   40    38 S   O2Z  _O13    50     1.26551   118.62490   -17.36559
   41    33 S   NT   _N8_    51     1.47353   109.09943   -70.28331
   42    41 S   H    _H18    52     1.01986   108.59236  -175.23609
   43    41 S   H    _H19    53     1.01450   110.44658    67.08105
   44    37 S   CM   _C5_    38     1.45724   121.66718  -104.65109
   45    44 S   HC   _H16    39     1.08601   115.70384    22.03266
   46    37 S   CMA  _C8_    45     1.52805   121.61922    68.38451
   47    46 S   OM   _O9_    46     1.26375   120.90026    88.38372
   48    46 S   OM   _O10    47     1.26432   120.64947   -92.92843
   49    44 S   CM   _C4_    40     1.33999   125.52509  -157.82770
   50    49 S   HC   _H15    41     1.08303   123.57156     0.35277
   51    49 S   CO4  _C6_    42     1.47571   119.04397  -179.81869
   52    51 S   O    _O34    43     1.22537   122.07114  -179.09821
   53    51 S   HC   _H17    44     1.10271   116.30353     0.81253
  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
  13   2   1   1  14   7   2   1   4   1   1   9   4   3   1   1
   4   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    38    41    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    44    46    38    39    40    41    42    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    44    45    49    46    47    48    38    39    40    41    42    43  
   35    36  
   36  
    0  
   44    45    49    50    51    46    47    48    38    39    40    41    42    43  
   39    40    41    42    43    44    46  
   40    41  
   41  
   42    43    44    46  
   43  
    0  
   45    49    50    51    52    53    46    47    48  
   49    50    51    46  
   47    48    49  
   48  
    0  
   50    51    52    53  
   51    52    53  
   52    53  
   53  
    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   0.247500   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  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   38   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   39   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   40   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   41   3.3000   0.1700  -0.900000   1.8650   1.6500   0.051222218  -2.220205820
   42   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   43   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   44   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   45   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0760   0.149000   2.0020   1.7750   0.023028004  -0.852763146
   47   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   48   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   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   0.450000   2.1120   1.8750   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.450000   1.6780   1.4800   0.001000000  -0.126889456
   53   2.4200   0.0150   0.000000   1.3810   1.2100   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   317.000  1.510
   33    38   317.000  1.522
   33    41   382.000  1.448
   37    44   380.000  1.444
   37    46   465.000  1.376
   44    45   340.000  1.080
   44    49   549.000  1.340
   49    50   340.000  1.080
   49    51   320.000  1.462
   51    52   570.000  1.229
   51    53   340.000  1.090
   46    47   745.000  1.250
   46    48   745.000  1.250
   38    39   656.000  1.250
   38    40   656.000  1.250
   41    42   434.000  1.010
   41    43   434.000  1.010
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    38    70.00000  116.78000
   29    33    41    85.00000  109.00000
   33    37    44    70.00000  124.00000
   33    37    46    70.00000  124.00000
   33    38    39    70.00000  117.00000
   33    38    40    70.00000  117.00000
   33    41    42    35.00000  109.50000
   33    41    43    35.00000  109.50000
   37    44    45    35.00000  120.00000
   37    44    49    70.00000  123.01800
   37    46    47    65.00000  137.10300
   37    46    48    65.00000  137.10300
   44    49    50    35.00000  120.00000
   44    49    51    65.00000  118.96000
   49    44    45    35.00000  120.00000
   49    51    52    80.00000  123.72100
   49    51    53    40.00000  115.75000
   51    49    50    40.00000  117.72500
   53    51    52    35.00000  123.00000
   46    37    44    70.00000  117.34000
   48    46    47    65.00000  121.00000
   38    33    37    65.00000  111.94000
   40    38    39    80.00000  126.00000
   41    33    37    75.00000  110.70900
   41    33    38    80.00000  109.96600
   43    41    42    43.60000  106.40000
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    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    41   0.01700  1.0 1.0
   24    29    33    41  -0.23550 -1.0 2.0
   24    29    33    41   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    44   0.42700  1.0 1.0
   29    33    37    44  -0.70350 -1.0 2.0
   29    33    37    44  -0.43150  1.0 3.0
   29    33    37    46   0.42700  1.0 1.0
   29    33    37    46  -0.70350 -1.0 2.0
   29    33    37    46  -0.43150  1.0 3.0
   29    33    38    39   0.30150 -1.0 2.0
   29    33    38    40   0.30150 -1.0 2.0
   29    33    41    42  -0.05900  1.0 1.0
   29    33    41    42   0.08350 -1.0 2.0
   29    33    41    42   0.12500  1.0 3.0
   29    33    41    43  -0.05900  1.0 1.0
   29    33    41    43   0.08350 -1.0 2.0
   29    33    41    43   0.12500  1.0 3.0
   33    37    44    45   0.00000  1.0 1.0
   33    37    44    49  -0.18600  1.0 3.0
   33    37    46    47   7.00000 -1.0 2.0
   33    37    46    48   7.00000 -1.0 2.0
   37    33    38    39   0.30150 -1.0 2.0
   37    33    38    40   0.30150 -1.0 2.0
   37    33    41    42   0.12450  1.0 1.0
   37    33    41    42  -0.40750 -1.0 2.0
   37    33    41    42   0.30300  1.0 3.0
   37    33    41    43   0.12450  1.0 1.0
   37    33    41    43  -0.40750 -1.0 2.0
   37    33    41    43   0.30300  1.0 3.0
   37    44    49    50   7.00000 -1.0 2.0
   37    44    49    51   7.00000 -1.0 2.0
   44    37    46    47   7.00000 -1.0 2.0
   44    37    46    48   7.00000 -1.0 2.0
   44    49    51    52   1.00000 -1.0 2.0
   44    49    51    53  -0.79650  1.0 1.0
   44    49    51    53   1.60950 -1.0 2.0
   44    49    51    53  -0.26250  1.0 3.0
   45    44    49    50   7.00000 -1.0 2.0
   45    44    49    51   7.00000 -1.0 2.0
   50    49    51    52   0.00000  1.0 1.0
   50    49    51    53   0.93100 -1.0 2.0
   46    37    44    45  -0.18600  1.0 3.0
   46    37    44    49   0.28850  1.0 1.0
   46    37    44    49   2.61350 -1.0 2.0
   46    37    44    49   0.78400  1.0 3.0
   38    33    37    44  -0.51250  1.0 1.0
   38    33    37    44  -0.88800 -1.0 2.0
   38    33    37    44   0.08850  1.0 3.0
   38    33    37    46  -0.51250  1.0 1.0
   38    33    37    46  -0.88800 -1.0 2.0
   38    33    37    46   0.08850  1.0 3.0
   38    33    41    42   0.21900  1.0 1.0
   38    33    41    42  -0.24900 -1.0 2.0
   38    33    41    42   0.15200  1.0 3.0
   38    33    41    43   0.21900  1.0 1.0
   38    33    41    43  -0.24900 -1.0 2.0
   38    33    41    43   0.15200  1.0 3.0
   41    33    37    44   0.90200  1.0 1.0
   41    33    37    44   0.57900 -1.0 2.0
   41    33    37    44  -0.62100  1.0 3.0
   41    33    37    46   0.90200  1.0 1.0
   41    33    37    46   0.57900 -1.0 2.0
   41    33    37    46  -0.62100  1.0 3.0
   41    33    38    39   0.30150 -1.0 2.0
   41    33    38    40   0.30150 -1.0 2.0
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
   36    30    34    35  10.50000 -1.0 2.0
   33    44    37    46  15.00000 -1.0 2.0
   37    45    44    49  15.00000 -1.0 2.0
   51    50    49    44  15.00000 -1.0 2.0
   49    53    51    52  10.50000 -1.0 2.0
   47    48    46    37  15.00000 -1.0 2.0
   39    33    38    40  10.50000 -1.0 2.0
END
