* LIGAND DATABASE FILE (OPLS2005)
*
001      52    52     90    139     267
    1     0 S   NP   _N1_     1    28.78413    94.97724   -24.29457
    2     1 S   H    _HN1     2     1.02828    29.42247  -178.91034
    3     1 S   H    _H1_     3     1.02787   111.90426   -91.14053
    4     1 S   H    _H2_     4     1.02949    78.40034    14.18518
    5     1 S   CT   _CA1     5     1.50115   128.79333   121.13677
    6     5 S   HC   _HA1     6     1.09574   105.18629    86.28246
    7     5 S   CO3  _C1_     7     1.53782   112.48989   -33.94250
    8     7 S   O2Z  _O11     8     1.26372   115.00344   -41.93318
    9     7 S   O2Z  _O12     9     1.26241   114.94445   137.19966
   10     5 S   CT   _CB1    10     1.53078   107.42251  -155.72744
   11    10 S   HC   HB11    11     1.09834   109.35607   -49.64249
   12    10 S   HC   HB12    12     1.09812   110.45292    66.96451
   13    10 S   CT   _CG1    13     1.52994   112.61476  -170.61615
   14    13 S   HC   HG11    14     1.09580   110.65157   -66.18286
   15    13 S   HC   HG12    15     1.09671   109.76446    53.05133
   16    13 S   C    _CD1    16     1.51801   112.20233   173.50816
   17    16 S   O    _OE1    17     1.22731   123.28420     8.05920
   18    16 S   N    _N2_    18     1.38658   111.68927  -172.03893
   19    18 S   H    _HN2    19     1.01579   118.89268     1.70846
   20    18 S   CT1  _CA2    20     1.46214   123.38464   177.14350
   21    20 S   HC   _HA2    21     1.09734   109.38578     3.08623
   22    20 S   C    _C2_    22     1.53559   108.49929  -112.37185
   23    22 S   O    _O2_    23     1.23051   122.31316  -147.38622
   24    20 S   CT   _CB2    32     1.53275   111.60364   125.15594
   25    24 S   HC   HB21    33     1.09636   110.14209    56.50881
   26    24 S   HC   HB22    34     1.09548   110.17195   175.09543
   27    22 S   N    _N3_    24     1.38329   113.69111    40.00078
   28    27 S   H    _HN3    25     1.01581   119.60192    -3.15970
   29    24 S   S    _SG2    35     1.82621   111.53788   -64.71547
   30    27 S   CT   _CA3    26     1.45288   123.23812   177.21723
   31    30 S   HC   HA31    27     1.09547   107.50084   -65.01267
   32    30 S   HC   HA32    28     1.09556   108.00519    51.44019
   33    29 S   CM   _C7_    36     1.74817    99.84371   174.30326
   34    30 S   CO3  _C3_    29     1.52966   114.05303   173.44794
   35    34 S   O2Z  _O31    30     1.26378   116.06041    -0.53887
   36    34 S   O2Z  _O32    31     1.26423   114.41734   179.52399
   37    33 S   CM   _C6_    37     1.34761   119.87644    73.60749
   38    37 S   HC   _H5_    38     1.08708   120.77732    -0.89787
   39    37 S   CM   _C5_    39     1.44859   121.85854   178.89890
   40    39 S   CM   _C4_    40     1.34276   120.74967    14.24975
   41    40 S   HC   _H4_    41     1.08624   120.73834   177.32307
   42    39 S   CO3  _C10    50     1.54316   118.04136  -167.93139
   43    42 S   O2Z  _O36    51     1.26546   115.82897    22.83546
   44    42 S   O2Z  _O35    52     1.26582   115.76773  -157.25547
   45    40 S   CT   _C9_    42     1.50471   121.25725    -0.92936
   46    45 S   HC   _H3_    43     1.09819   107.46924    96.32097
   47    33 S   CT   _C8_    44     1.52587   119.62952  -108.18260
   48    47 S   Cl   Cl1_    45     1.80510   107.34884   -81.34746
   49    45 S   OH   _O33    48     1.42855   110.02538  -149.22993
   50    49 S   HO   _H6_    49     0.97234   107.84212   -55.07552
   51    47 S   OH   _O34    46     1.42999   111.37812    35.66642
   52    51 S   HO   _H7_    47     0.97175   107.71741    52.50618
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   7   3   2   7   4   8   5   4   3
  12   2   1   1  11   4   9  11   5   3   1   1   7   5   5   3
   2   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    47    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    45    47    48    51  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    40    45    46    47    48    51    52    49    42  
   35    36  
   36  
    0  
   38    39    40    41    45    47    48    51    42    43    44  
   39    40    47    42  
   40    41    45    46    47    49    42    43    44  
   41    45    46    47    48    51    49    50    42    43    44  
   45    46    47    49    42  
   43    44    45  
   44  
    0  
   46    47    48    51    52    49    50  
   47    48    51    49    50  
   48    51    52    49    50  
   51    52    49  
   50    51  
    0  
   52  
    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   3.5500   0.0760   0.007500   2.0020   1.7750   0.023028004  -0.852763146
   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  -0.115000   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  -0.310300   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   41   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   42   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   45   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660   0.465000   1.9750   1.7500   0.005000000  -0.741685710
   48   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   49   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   50   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   51   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   52   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    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   240.000  1.763
   33    37   549.000  1.340
   33    47   317.000  1.510
   37    38   340.000  1.080
   37    39   380.000  1.444
   39    40   549.000  1.340
   39    42   230.000  1.545
   40    41   340.000  1.080
   40    45   317.000  1.510
   45    46   340.000  1.090
   45    47   268.000  1.529
   45    49   320.000  1.410
   47    48   245.000  1.781
   47    51   320.000  1.410
   51    52   553.000  0.945
   49    50   553.000  0.945
   42    43   656.000  1.250
   42    44   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    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    85.00000  102.41200
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    65.00000  122.11800
   29    33    47    65.00000  117.37300
   33    37    38    35.00000  120.00000
   33    37    39    70.00000  123.01800
   33    47    45    70.00000  112.02700
   33    47    48    75.00000  111.90500
   33    47    51    90.00000  110.39200
   37    39    40    70.00000  123.01800
   37    39    42    55.00000  124.75400
   39    37    38    35.00000  120.00000
   39    40    41    35.00000  120.00000
   39    40    45    70.00000  124.00000
   39    42    43    85.00000  113.83300
   39    42    44    85.00000  113.83300
   40    45    46    35.00000  109.50000
   40    45    47    70.00000  112.02700
   40    45    49    90.00000  110.39200
   45    40    41    35.00000  117.00000
   45    47    48    69.00000  109.80000
   45    47    51    50.00000  109.50000
   45    49    50    55.00000  108.50000
   47    33    37    70.00000  124.00000
   47    45    46    37.50000  110.70000
   47    51    52    55.00000  108.50000
   51    47    48    95.00000  108.90000
   49    45    46    35.00000  109.50000
   49    45    47    50.00000  109.50000
   42    39    40    55.00000  124.75400
   44    42    43    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   0.00000  1.0 1.0
   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   1.00000 -1.0 2.0
   24    29    33    47   1.00000 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    37    38   7.00000 -1.0 2.0
   29    33    37    39   7.00000 -1.0 2.0
   29    33    47    45   0.09700  1.0 1.0
   29    33    47    45   0.15600 -1.0 2.0
   29    33    47    45  -0.50800  1.0 3.0
   29    33    47    48   0.09700  1.0 1.0
   29    33    47    48   0.15600 -1.0 2.0
   29    33    47    48  -0.50800  1.0 3.0
   29    33    47    51   0.09700  1.0 1.0
   29    33    47    51   0.15600 -1.0 2.0
   29    33    47    51  -0.50800  1.0 3.0
   33    37    39    40   0.28850  1.0 1.0
   33    37    39    40   2.61350 -1.0 2.0
   33    37    39    40   0.78400  1.0 3.0
   33    37    39    42  -0.18600  1.0 3.0
   33    47    51    52  -0.07800  1.0 1.0
   33    47    51    52  -0.21500 -1.0 2.0
   33    47    51    52  -0.03150  1.0 3.0
   37    33    47    45   0.09850  1.0 1.0
   37    33    47    45   0.15250 -1.0 2.0
   37    33    47    45  -0.50650  1.0 3.0
   37    33    47    48   0.09700  1.0 1.0
   37    33    47    48   0.15600 -1.0 2.0
   37    33    47    48  -0.50800  1.0 3.0
   37    33    47    51   0.67800  1.0 1.0
   37    33    47    51   0.47050 -1.0 2.0
   37    33    47    51  -0.62500  1.0 3.0
   37    39    40    41   7.00000 -1.0 2.0
   37    39   -40    45   7.00000 -1.0 2.0
   37    39    42    43  -0.04000 -1.0 2.0
   37    39    42    43  -0.29050  1.0 3.0
   37    39    42    44  -0.04000 -1.0 2.0
   37    39    42    44  -0.29050  1.0 3.0
   38    37    39    40  -0.18600  1.0 3.0
   38    37    39    42   0.00000  1.0 1.0
   39    40    45    46   0.00000  1.0 1.0
   39    40    45    47   0.09850  1.0 1.0
   39    40    45    47   0.15250 -1.0 2.0
   39    40    45    47  -0.50650  1.0 3.0
   39    40    45    49   0.67800  1.0 1.0
   39    40    45    49   0.47050 -1.0 2.0
   39    40    45    49  -0.62500  1.0 3.0
   40    39    42    43  -0.04000 -1.0 2.0
   40    39    42    43  -0.29050  1.0 3.0
   40    39    42    44  -0.04000 -1.0 2.0
   40    39    42    44  -0.29050  1.0 3.0
   40    45   -47    33   0.31000  1.0 1.0
   40    45   -47    33   0.14700 -1.0 2.0
   40    45   -47    33   0.07550  1.0 3.0
   40    45    47    48   0.56750  1.0 1.0
   40    45    47    48  -0.07550 -1.0 2.0
   40    45    47    48   0.20000  1.0 3.0
   40    45    47    51   1.05650  1.0 1.0
   40    45    47    51   0.15600 -1.0 2.0
   40    45    47    51   0.53150  1.0 3.0
   40    45    49    50  -0.07800  1.0 1.0
   40    45    49    50  -0.21500 -1.0 2.0
   40    45    49    50  -0.03150  1.0 3.0
   41    40    45    46   0.33100  1.0 3.0
   41    40    45    47   0.00000  1.0 1.0
   41    40    45    49   0.00000  1.0 1.0
   45    47    51    52  -0.11600  1.0 1.0
   45    47    51    52  -0.09450 -1.0 2.0
   45    47    51    52   0.21250  1.0 3.0
   46    45    47    33   0.15000  1.0 3.0
   46    45    47    48   0.27000  1.0 3.0
   46    45    47    51   0.23400  1.0 3.0
   46    45    49    50   0.19450  1.0 3.0
   47    33    37    38   7.00000 -1.0 2.0
   47    33   -37    39   7.00000 -1.0 2.0
   47    45    49    50  -0.11600  1.0 1.0
   47    45    49    50  -0.09450 -1.0 2.0
   47    45    49    50   0.21250  1.0 3.0
   48    47    51    52   0.35600  1.0 1.0
   48    47    51    52  -0.10750 -1.0 2.0
   48    47    51    52  -0.54400  1.0 3.0
   49    45    47    33   1.05650  1.0 1.0
   49    45    47    33   0.15600 -1.0 2.0
   49    45    47    33   0.53150  1.0 3.0
   49    45    47    48   0.56750  1.0 1.0
   49    45    47    48  -0.07550 -1.0 2.0
   49    45    47    48   0.20000  1.0 3.0
   49    45    47    51   3.75450  1.0 1.0
   42    39    40    41   7.00000 -1.0 2.0
   42    39    40    45   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
   29    47    33    37   1.10000 -1.0 2.0
   39    38    37    33   1.10000 -1.0 2.0
   37    42    39    40   1.10000 -1.0 2.0
   45    41    40    39   1.10000 -1.0 2.0
   43    39    42    44  10.50000 -1.0 2.0
END
