* LIGAND DATABASE FILE (OPLS2005)
*
001      50    50     86    129     250
    1     0 S   NP   _N1_     1    28.87791    96.51107   -22.95425
    2     1 S   H    _HN1     2     1.02948    69.73472     4.76300
    3     1 S   H    _H1_     3     1.02828    40.40326   161.32823
    4     1 S   H    _H2_     4     1.02795   105.74088   -99.40974
    5     1 S   CT   _CA1     5     1.50124   139.16866   102.91020
    6     5 S   HC   _HA1     6     1.09573   105.16932    95.49662
    7     5 S   CO3  _C1_     7     1.53770   112.41734   -24.72807
    8     7 S   O2Z  _O11     8     1.26376   115.00928   -43.63020
    9     7 S   O2Z  _O12     9     1.26231   114.94307   135.35956
   10     5 S   CT   _CB1    10     1.53056   107.40016  -146.54358
   11    10 S   HC   HB11    11     1.09841   109.34980   -49.35284
   12    10 S   HC   HB12    12     1.09810   110.47851    67.24351
   13    10 S   CT   _CG1    13     1.53020   112.62864  -170.27381
   14    13 S   HC   HG11    14     1.09570   110.73751   -66.95287
   15    13 S   HC   HG12    15     1.09669   109.69918    52.29672
   16    13 S   C    _CD1    16     1.51814   111.96348   172.79709
   17    16 S   O    _OE1    17     1.22762   123.15898    12.42526
   18    16 S   N    _N2_    18     1.38615   111.84091  -167.59889
   19    18 S   H    _HN2    19     1.01598   119.10063     0.90049
   20    18 S   CT1  _CA2    20     1.46254   123.43364   176.92432
   21    20 S   HC   _HA2    21     1.09741   109.20455     8.73844
   22    20 S   C    _C2_    22     1.53742   109.27876  -106.81010
   23    22 S   O    _O2_    23     1.23100   122.17601  -152.22337
   24    20 S   CT   _CB2    32     1.53388   111.43297   130.63845
   25    24 S   HC   HB21    33     1.09482   109.49023    56.31835
   26    24 S   HC   HB22    34     1.09439   109.94866   175.15273
   27    22 S   N    _N3_    24     1.38302   114.02489    35.41837
   28    27 S   H    _HN3    25     1.01524   119.60001    -3.55787
   29    24 S   S    _SG2    35     1.83174   111.13816   -65.00364
   30    27 S   CT   _CA3    26     1.45268   123.29120   177.14015
   31    30 S   HC   HA31    27     1.09547   107.55924   -63.85310
   32    30 S   HC   HA32    28     1.09556   107.94660    52.59909
   33    29 S   CT   _C7_    36     1.84911   100.88787   175.43808
   34    33 S   Cl   Cl1_    37     1.80933   107.85539  -179.04407
   35    30 S   CO3  _C3_    29     1.52973   114.04345   174.59195
   36    35 S   O2Z  _O31    30     1.26385   116.09491     0.61326
   37    35 S   O2Z  _O32    31     1.26429   114.41425  -179.36050
   38    33 S   CM   _C6_    38     1.52254   111.98498    60.99579
   39    38 S   Cl   Cl2_    39     1.75020   116.53890    58.72163
   40    38 S   CM   _C5_    40     1.35274   123.95919  -121.44808
   41    40 S   CM   _C4_    41     1.46462   116.99903    -0.31341
   42    41 S   Cl   Cl3_    42     1.73719   118.35326   178.51628
   43    40 S   NE   _N5_    48     1.37159   124.09018   179.76261
   44    43 S   H    _H3_    49     1.01225   119.68432  -179.87489
   45    43 S   H    _H4_    50     1.01205   119.63884    -0.13270
   46    41 S   CMA  _C8_    43     1.35001   118.34464    -1.67328
   47    33 S   NM   _N4_    44     1.47041   108.35219   -67.42622
   48    46 S   CO3  _C9_    45     1.54939   115.89677  -179.69545
   49    48 S   O2Z  _O34    46     1.26588   115.19122    89.10645
   50    48 S   O2Z  _O33    47     1.26629   115.04376   -91.02654
  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   7   5   4   3
   9   5   2   1   1   9   4   8   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    47    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    46    47  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    46    47    48    43  
   38    39    40    46    47  
   36    37  
   37  
    0  
   39    40    41    42    46    47    43    44    45  
   40    41    47    43  
   41    42    46    47    48    43    44    45  
   42    46    47    48    49    50    43    44    45  
   46    47    48    43  
   44    45    46  
   45  
    0  
   47    48    49    50  
   48    49    50  
   49    50  
   50  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.175000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.330000   1.9750   1.7500   0.005000000  -0.741685710
   34   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   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   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   39   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   40   3.5500   0.0760   0.018000   2.0020   1.7750   0.023028004  -0.852763146
   41   3.5500   0.0760  -0.499200   2.0020   1.7750   0.023028004  -0.852763146
   42   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   43   3.2500   0.1700  -0.725400   1.8650   1.6500   0.051222218  -2.220205820
   44   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   45   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   46   3.5500   0.0760   0.741700   2.0020   1.7750   0.023028004  -0.852763146
   47   3.4200   0.1700  -1.245000   1.9310   1.7100   0.005000000   0.000000000
   48   3.7500   0.1050   0.600000   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
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   245.000  1.781
   33    38   317.000  1.510
   33    47   320.000  1.444
   38    39   300.000  1.725
   38    40   549.000  1.340
   40    41   380.000  1.444
   40    43   425.000  1.378
   41    42   300.000  1.725
   41    46   465.000  1.376
   46    47   500.000  1.344
   46    48   230.000  1.545
   48    49   656.000  1.250
   48    50   656.000  1.250
   43    44   434.000  1.010
   43    45   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    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    85.00000  110.65400
   29    33    38    75.00000  112.20000
   29    33    47    85.00000  109.00000
   33    38    39    75.00000  111.02000
   33    38    40    70.00000  124.00000
   33    47    46    70.00000  118.22000
   38    33    34    75.00000  111.90500
   38    40    41    70.00000  123.01800
   38    40    43    70.00000  124.03900
   40    38    39    75.00000  121.50000
   40    41    42    75.00000  121.50000
   40    41    46    70.00000  117.34000
   40    43    44    35.00000  114.50000
   40    43    45    35.00000  114.50000
   41    46    47    65.00000  126.19400
   41    46    48    55.00000  124.75400
   46    41    42    60.00000  123.80000
   46    48    49    85.00000  113.83300
   46    48    50    85.00000  113.83300
   47    33    34    85.00000  105.00000
   47    33    38    75.00000  116.00000
   48    46    47    65.00000  124.00000
   50    48    49    80.00000  126.00000
   43    40    41    70.00000  124.03900
   45    43    44    35.00000  109.00000
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    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   0.01700  1.0 1.0
   24    29    33    34  -0.23550 -1.0 2.0
   24    29    33    34   0.21350  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    47   0.01700  1.0 1.0
   24    29    33    47  -0.23550 -1.0 2.0
   24    29    33    47   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    39   0.09700  1.0 1.0
   29    33    38    39   0.15600 -1.0 2.0
   29    33    38    39  -0.50800  1.0 3.0
   29    33    38    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    47    46   0.00000  1.0 1.0
   33    38    40    41   7.00000 -1.0 2.0
   33    38    40    43   7.00000 -1.0 2.0
   34    33    38    39   0.09700  1.0 1.0
   34    33    38    39   0.15600 -1.0 2.0
   34    33    38    39  -0.50800  1.0 3.0
   34    33    38    40   0.09700  1.0 1.0
   34    33    38    40   0.15600 -1.0 2.0
   34    33    38    40  -0.50800  1.0 3.0
   34    33    47    46   0.00000  1.0 1.0
   38    33    47    46   0.00000  1.0 1.0
   38    40    41    42  -0.18600  1.0 3.0
   38    40   -41    46   0.28850  1.0 1.0
   38    40   -41    46   2.61350 -1.0 2.0
   38    40   -41    46   0.78400  1.0 3.0
   38    40    43    44   1.00000 -1.0 2.0
   38    40    43    45   1.00000 -1.0 2.0
   39    38    40    41   7.00000 -1.0 2.0
   39    38    40    43   7.00000 -1.0 2.0
   40    41    46    47   7.00000 -1.0 2.0
   40    41    46    48   7.00000 -1.0 2.0
   41    40    43    44   1.00000 -1.0 2.0
   41    40    43    45   1.00000 -1.0 2.0
   41    46   -47    33   0.00000  1.0 1.0
   41    46    48    49  -0.04000 -1.0 2.0
   41    46    48    49  -0.29050  1.0 3.0
   41    46    48    50  -0.04000 -1.0 2.0
   41    46    48    50  -0.29050  1.0 3.0
   42    41    46    47   7.00000 -1.0 2.0
   42    41    46    48   7.00000 -1.0 2.0
   47    33    38    39   0.09700  1.0 1.0
   47    33    38    39   0.15600 -1.0 2.0
   47    33    38    39  -0.50800  1.0 3.0
   47    33   -38    40   0.09700  1.0 1.0
   47    33   -38    40   0.15600 -1.0 2.0
   47    33   -38    40  -0.50800  1.0 3.0
   47    46    48    49   1.68800 -1.0 2.0
   47    46    48    50   1.68800 -1.0 2.0
   48    46    47    33   0.00000  1.0 1.0
   43    40    41    42   1.08500 -1.0 2.0
   43    40    41    46  -0.18600  1.0 3.0
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    39    38    40   1.10000 -1.0 2.0
   41    43    40    38   1.10000 -1.0 2.0
   40    42    41    46   1.10000 -1.0 2.0
   48    47    46    41   1.10000 -1.0 2.0
   49    46    48    50  10.50000 -1.0 2.0
   45    40    43    44   1.00000 -1.0 2.0
END
