* LIGAND DATABASE FILE (OPLS2005)
*
001      59    58    101    147     295
    1     0 S   NP   _N1_     1    28.88054    95.39643   -24.34427
    2     1 S   H    _HN1     2     1.02793   112.85400  -102.05916
    3     1 S   H    _H1_     3     1.02946    76.76852     2.54699
    4     1 S   H    _H2_     4     1.02826    30.95632   171.09029
    5     1 S   CT   _CA1     5     1.50125   128.79011   108.27224
    6     5 S   HC   _HA1     6     1.09575   105.17244    88.59987
    7     5 S   CO3  _C1_     7     1.53760   112.37451   -31.62108
    8     7 S   O2Z  _O11     8     1.26374   115.01026   -44.58617
    9     7 S   O2Z  _O12     9     1.26225   114.92982   134.36922
   10     5 S   CT   _CB1    10     1.53054   107.40044  -153.46644
   11    10 S   HC   HB11    11     1.09844   109.32909   -49.52334
   12    10 S   HC   HB12    12     1.09809   110.48876    67.05606
   13    10 S   CT   _CG1    13     1.53032   112.64889  -170.44850
   14    13 S   HC   HG11    14     1.09573   110.74869   -67.04614
   15    13 S   HC   HG12    15     1.09668   109.70546    52.21041
   16    13 S   C    _CD1    16     1.51826   111.91757   172.69516
   17    16 S   O    _OE1    17     1.22765   123.14380    12.55702
   18    16 S   N    _N2_    18     1.38602   111.86079  -167.45910
   19    18 S   H    _HN2    19     1.01602   119.09768     0.70969
   20    18 S   CT1  _CA2    20     1.46320   123.43715   176.91333
   21    20 S   HC   _HA2    21     1.09740   109.17622     8.47021
   22    20 S   C    _C2_    22     1.53729   109.38491  -107.05798
   23    22 S   O    _O2_    23     1.23092   122.16121  -153.63106
   24    20 S   CT   _CB2    32     1.53325   111.29738   130.32016
   25    24 S   HC   HB21    33     1.09405   109.41906    55.72249
   26    24 S   HC   HB22    34     1.09494   110.59317   174.88764
   27    22 S   N    _N3_    24     1.38304   114.05840    34.00687
   28    27 S   H    _HN3    25     1.01523   119.58111    -3.68206
   29    24 S   S    _SG2    35     1.82659   111.17113   -65.23734
   30    27 S   CT   _CA3    26     1.45268   123.29501   177.08731
   31    30 S   HC   HA31    27     1.09548   107.57864   -63.39678
   32    30 S   HC   HA32    28     1.09556   107.92657    53.05457
   33    29 S   CT   _C6_    36     1.82840    99.66347   177.53312
   34    33 S   HC   _H3_    37     1.09555   107.42863    52.41590
   35    30 S   CO3  _C3_    29     1.52970   114.03900   175.03272
   36    35 S   O2Z  _O31    30     1.26386   116.08975     0.70193
   37    35 S   O2Z  _O32    31     1.26427   114.41988  -179.27315
   38    33 S   CM   _C7_    38     1.50798   112.34894   -70.02433
   39    33 S   N    _N4_    52     1.45393   109.83389   168.87783
   40    39 S   H    _H8_    53     1.01819   117.48120    98.39978
   41    38 S   CMA  _C8_    39     1.52372   117.24258   129.02678
   42    41 S   OM   _O34    40     1.26259   120.47396   -83.93364
   43    41 S   OM   _O35    41     1.26174   120.67446    94.88674
   44    38 S   CT   _C9_    42     1.51951   122.28482   -54.75719
   45    44 S   HC   _H4_    43     1.09777   109.86444    13.40407
   46    39 S   C    _C5_    54     1.38184   123.51488   -82.96408
   47    46 S   O    _O33    55     1.22795   125.85428     1.35248
   48    44 S   CO3  _C11    44     1.54492   110.16715  -100.99819
   49    48 S   O2Z  _O38    45     1.26789   115.04588    63.57617
   50    48 S   O2Z  _O37    46     1.26468   116.42407  -120.11053
   51    44 S   CT   _C10    47     1.53150   111.37938   131.80810
   52    51 S   HC   _H9_    48     1.09514   110.85524   -48.84536
   53    51 S   HC   _H10    49     1.09543   112.83655    72.30297
   54    46 S   CT   _C4_    56     1.50474   112.16962  -179.37317
   55    54 S   HC   _H5_    57     1.09380   110.12079    52.80186
   56    54 S   HC   _H6_    58     1.09346   109.72685   172.47522
   57    54 S   HC   _H7_    59     1.09351   109.58184   -67.69492
   58    51 S   OH   _O36    50     1.42684   110.23323  -166.74029
   59    58 S   HO   _H11    51     0.97420   106.26189   -63.49967
  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   8   5   4   3
  14   6   2   1   1  15   9   3   6   2   1   9   7   5   4   6
   2   1   4   3   2   3   2   1   1   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    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    44    39    40    46  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    43    44    45    48    51    39    40    46    47    54  
   38    41    44    39    40    46  
   36    37  
   37  
    0  
   41    42    43    44    45    48    49    50    51    52    53    58    39    40    46  
   40    46    47    54    55    56    57    41    44  
   46    47    54  
   42    43    44    45    48    51  
   43    44  
   44  
   45    48    49    50    51    52    53    58    59  
   48    49    50    51    52    53    58  
   47    54    55    56    57  
   54    55    56    57  
   49    50    51    52    53    58  
   50    51  
   51  
   52    53    58    59  
   53    58    59  
   58    59  
   55    56    57  
   56    57  
   57  
    0  
   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   0.307500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   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   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   39   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   40   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   41   3.5500   0.0760   0.149000   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   43   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   44   3.5000   0.0660  -0.160000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   46   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   47   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   48   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   49   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   50   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   51   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   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  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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    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   340.000  1.090
   33    38   317.000  1.510
   33    39   337.000  1.449
   38    41   465.000  1.376
   38    44   317.000  1.510
   41    42   745.000  1.250
   41    43   745.000  1.250
   44    45   340.000  1.090
   44    48   317.000  1.522
   44    51   268.000  1.529
   48    49   656.000  1.250
   48    50   656.000  1.250
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    58   320.000  1.410
   58    59   553.000  0.945
   39    40   434.000  1.010
   39    46   490.000  1.335
   46    47   570.000  1.229
   46    54   317.000  1.522
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   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    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    39    80.00000  108.62000
   33    38    41    70.00000  124.00000
   33    38    44    65.00000  117.92700
   33    39    40    38.00000  118.40000
   33    39    46    50.00000  121.90000
   38    33    34    35.00000  109.50000
   38    41    42    65.00000  137.10300
   38    41    43    65.00000  137.10300
   38    44    45    35.00000  109.50000
   38    44    48    65.00000  111.94000
   38    44    51    70.00000  112.02700
   43    41    42    65.00000  121.00000
   44    38    41    70.00000  124.00000
   44    48    49    70.00000  117.00000
   44    48    50    70.00000  117.00000
   44    51    52    37.50000  110.70000
   44    51    53    37.50000  110.70000
   44    51    58    50.00000  109.50000
   48    44    45    35.00000  109.50000
   50    48    49    80.00000  126.00000
   51    44    45    37.50000  110.70000
   51    44    48    70.00000  109.69300
   51    58    59    55.00000  108.50000
   53    51    52    33.00000  107.80000
   58    51    52    35.00000  109.50000
   58    51    53    35.00000  109.50000
   39    33    34    35.00000  109.50000
   39    33    38    75.00000  110.78400
   39    46    47    80.00000  122.90000
   39    46    54    70.00000  116.60000
   46    39    40    35.00000  119.80000
   46    54    55    35.00000  109.50000
   46    54    56    35.00000  109.50000
   46    54    57    35.00000  109.50000
   54    46    47    80.00000  120.40000
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    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   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   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    41   0.42700  1.0 1.0
   29    33    38    41  -0.70350 -1.0 2.0
   29    33    38    41  -0.43150  1.0 3.0
   29    33    38    44   0.30250  1.0 1.0
   29    33    38    44  -0.14950 -1.0 2.0
   29    33    38    44   0.36900  1.0 3.0
   29    33    39    40   0.00000  1.0 1.0
   29    33    39    46  -0.42300  1.0 1.0
   29    33    39    46  -0.07000 -1.0 2.0
   29    33    39    46   0.04150  1.0 3.0
   33    38    41    42   7.00000 -1.0 2.0
   33    38    41    43   7.00000 -1.0 2.0
   33    38    44    45   0.34800  1.0 3.0
   33    38    44    48   0.17250  1.0 1.0
   33    38    44    48  -0.04100 -1.0 2.0
   33    38    44    48  -0.33850  1.0 3.0
   33    38    44    51   0.46850  1.0 1.0
   33    38    44    51   0.08550 -1.0 2.0
   33    38    44    51   0.09800  1.0 3.0
   33    39    46    47   3.04450 -1.0 2.0
   33    39    46    54   1.49850  1.0 1.0
   33    39    46    54   1.53950 -1.0 2.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    44   0.34800  1.0 3.0
   34    33    39    40   0.00000  1.0 1.0
   34    33    39    46   0.00000  1.0 1.0
   38    33    39    40   0.00000  1.0 1.0
   38    33    39    46  -0.19250  1.0 1.0
   38    33    39    46  -0.00500 -1.0 2.0
   38    33    39    46   0.17000  1.0 3.0
   38    44    48    49   0.30150 -1.0 2.0
   38    44    48    50   0.30150 -1.0 2.0
   38    44    51    52   0.15000  1.0 3.0
   38    44    51    53   0.15000  1.0 3.0
   38    44    51    58   1.05650  1.0 1.0
   38    44    51    58   0.15600 -1.0 2.0
   38    44    51    58   0.53150  1.0 3.0
   41    38    44    45   0.00000  1.0 1.0
   41    38    44    48  -0.51250  1.0 1.0
   41    38    44    48  -0.88800 -1.0 2.0
   41    38    44    48   0.08850  1.0 3.0
   41    38    44    51   0.09850  1.0 1.0
   41    38    44    51   0.15250 -1.0 2.0
   41    38    44    51  -0.50650  1.0 3.0
   44    38    41    42   7.00000 -1.0 2.0
   44    38    41    43   7.00000 -1.0 2.0
   44    51    58    59  -0.11600  1.0 1.0
   44    51    58    59  -0.09450 -1.0 2.0
   44    51    58    59   0.21250  1.0 3.0
   45    44    48    49   0.00000  1.0 1.0
   45    44    48    50   0.00000  1.0 1.0
   45    44    51    52   0.15000  1.0 3.0
   45    44    51    53   0.15000  1.0 3.0
   45    44    51    58   0.23400  1.0 3.0
   48    44    51    52  -0.11250  1.0 3.0
   48    44    51    53  -0.11250  1.0 3.0
   48    44    51    58  -5.33000  1.0 1.0
   48    44    51    58  -0.54250 -1.0 2.0
   48    44    51    58  -0.07300  1.0 3.0
   51    44    48    49   0.41150 -1.0 2.0
   51    44    48    50   0.41150 -1.0 2.0
   52    51    58    59   0.19450  1.0 3.0
   53    51    58    59   0.19450  1.0 3.0
   39    33    38    41   0.62150  1.0 1.0
   39    33    38    41   0.42850 -1.0 2.0
   39    33    38    41  -0.68200  1.0 3.0
   39    33    38    44   0.09700  1.0 1.0
   39    33    38    44   0.15600 -1.0 2.0
   39    33    38    44  -0.50800  1.0 3.0
   39    46    54    55   0.00000  1.0 1.0
   39    46    54    56   0.00000  1.0 1.0
   39    46    54    57   0.00000  1.0 1.0
   40    39    46    47   2.45000 -1.0 2.0
   40    39    46    54   2.45000 -1.0 2.0
   47    46    54    55   0.00000  1.0 1.0
   47    46    54    56   0.00000  1.0 1.0
   47    46    54    57   0.00000  1.0 1.0
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
   33    44    38    41  15.00000 -1.0 2.0
   42    43    41    38  15.00000 -1.0 2.0
   49    44    48    50  10.50000 -1.0 2.0
   40    46    39    33   1.00000 -1.0 2.0
   39    54    46    47  10.50000 -1.0 2.0
END
