* LIGAND DATABASE FILE (OPLS2005)
*
001      49    49     86    130     252
    1     0 S   NP   _N1_     1    28.81122    95.71991   -23.38002
    2     1 S   H    _HN1     2     1.02949    75.50897     9.57844
    3     1 S   H    _H1_     3     1.02829    34.15855   166.66836
    4     1 S   H    _H2_     4     1.02789   106.51356   -95.66040
    5     1 S   CT   _CA1     5     1.50111   135.72111   114.12305
    6     5 S   HC   _HA1     6     1.09574   105.18702    87.71092
    7     5 S   CO3  _C1_     7     1.53782   112.47255   -32.52064
    8     7 S   O2Z  _O11     8     1.26372   115.01004   -42.58972
    9     7 S   O2Z  _O12     9     1.26240   114.94296   136.53421
   10     5 S   CT   _CB1    10     1.53076   107.42317  -154.31082
   11    10 S   HC   HB11    11     1.09835   109.35881   -49.67858
   12    10 S   HC   HB12    12     1.09812   110.45882    66.92743
   13    10 S   CT   _CG1    13     1.52998   112.60867  -170.64554
   14    13 S   HC   HG11    14     1.09579   110.65747   -66.11538
   15    13 S   HC   HG12    15     1.09671   109.75807    53.11647
   16    13 S   C    _CD1    16     1.51802   112.18160   173.57633
   17    16 S   O    _OE1    17     1.22736   123.26905     8.30752
   18    16 S   N    _N2_    18     1.38652   111.70823  -171.74029
   19    18 S   H    _HN2    19     1.01581   118.94582     1.56548
   20    18 S   CT1  _CA2    20     1.46210   123.40545   177.21020
   21    20 S   HC   _HA2    21     1.09737   109.33026     4.83205
   22    20 S   C    _C2_    22     1.53605   108.75611  -110.65664
   23    22 S   O    _O2_    23     1.23070   122.25634  -148.69207
   24    20 S   CT   _CB2    32     1.53268   111.56287   126.83579
   25    24 S   HC   HB21    33     1.09646   110.14272    56.43569
   26    24 S   HC   HB22    34     1.09559   110.27303   175.07172
   27    22 S   N    _N3_    24     1.38317   113.79359    38.80435
   28    27 S   H    _HN3    25     1.01567   119.60539    -3.25654
   29    24 S   S    _SG2    35     1.82597   111.59521   -64.83764
   30    27 S   CT   _CA3    26     1.45288   123.25119   177.15077
   31    30 S   HC   HA31    27     1.09548   107.51069   -64.73581
   32    30 S   HC   HA32    28     1.09556   107.99443    51.71575
   33    29 S   CM   _C8_    36     1.74812    99.27433   178.33399
   34    30 S   CO3  _C3_    29     1.52968   114.05181   173.71646
   35    34 S   O2Z  _O31    30     1.26380   116.06435    -0.50899
   36    34 S   O2Z  _O32    31     1.26423   114.41862   179.55063
   37    33 S   CM   _C7_    37     1.34747   119.59138   -88.29488
   38    37 S   HC   _H6_    38     1.09028   119.75569    -0.10468
   39    37 S   CT   _C6_    39     1.51933   124.17979   178.43215
   40    39 S   OM   _O34    40     1.32234   105.73859   112.81968
   41    39 S   HC   _H3_    41     1.10059   104.61417  -118.97255
   42    39 S   CM   _C5_    42     1.51873   112.17910    -4.88383
   43    42 S   Cl   Cl1_    43     1.73943   116.81733  -170.64285
   44    42 S   CM   _C4_    44     1.34286   123.84162     5.09439
   45    44 S   HC   _H5_    45     1.08680   120.10645  -178.59765
   46    33 S   CT   _C9_    46     1.51241   118.16299    90.41406
   47    46 S   HC   _H4_    47     1.09708   109.00812   -52.90951
   48    46 S   OH   _O33    48     1.42698   109.32373    64.53156
   49    48 S   HO   _H7_    49     0.97184   107.82460   178.67101
  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  10   5   7   4   3   6   3   5   3   3   2   1
   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    46    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    44    46    47    48  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    40    41    42    44    45    46    47    48    49  
   35    36  
   36  
    0  
   38    39    40    41    42    43    44    46    47    48  
   39    40    41    42    46  
   40    41    42    43    44    45    46  
   41    42    43    44  
   42    43    44  
   43    44    45    46    47    48  
   44    45    46  
   45    46    47    48    49  
   46    47    48  
   47    48    49  
   48    49  
   49  
    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   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   40   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   41   2.5000   0.0500   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   43   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   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   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   49   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    46   317.000  1.510
   37    38   340.000  1.080
   37    39   317.000  1.510
   39    40   570.000  1.307
   39    41   340.000  1.090
   39    42   317.000  1.510
   42    43   300.000  1.725
   42    44   549.000  1.340
   44    45   340.000  1.080
   44    46   317.000  1.510
   46    47   340.000  1.090
   46    48   320.000  1.410
   48    49   553.000  0.945
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    46    65.00000  117.37300
   33    37    38    35.00000  120.00000
   33    37    39    70.00000  124.00000
   33    46    44    70.00000  110.12100
   33    46    47    35.00000  109.50000
   33    46    48    90.00000  110.39200
   37    39    40    85.00000  110.90400
   37    39    41    35.00000  109.50000
   37    39    42    70.00000  110.12100
   39    37    38    35.00000  117.00000
   39    42    43    75.00000  111.02000
   39    42    44    70.00000  124.00000
   41    39    40    45.00000  125.66300
   42    39    40    85.00000  110.90400
   42    39    41    35.00000  109.50000
   42    44    45    35.00000  120.00000
   42    44    46    70.00000  124.00000
   44    42    43    75.00000  121.50000
   44    46    47    35.00000  109.50000
   44    46    48    90.00000  110.39200
   46    33    37    70.00000  124.00000
   46    44    45    35.00000  117.00000
   46    48    49    55.00000  108.50000
   48    46    47    35.00000  109.50000
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    46   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    46    44   0.09700  1.0 1.0
   29    33    46    44   0.15600 -1.0 2.0
   29    33    46    44  -0.50800  1.0 3.0
   29    33    46    47   0.00000  1.0 1.0
   29    33    46    48   0.09700  1.0 1.0
   29    33    46    48   0.15600 -1.0 2.0
   29    33    46    48  -0.50800  1.0 3.0
   33    37    39    40   0.39000  1.0 1.0
   33    37    39    40  -0.05800 -1.0 2.0
   33    37    39    40  -0.55150  1.0 3.0
   33    37    39    41   0.00000  1.0 1.0
   33    37    39    42  -0.28300  1.0 1.0
   33    37    39    42   0.26700 -1.0 2.0
   33    37    39    42  -0.63300  1.0 3.0
   33    46    48    49  -0.07800  1.0 1.0
   33    46    48    49  -0.21500 -1.0 2.0
   33    46    48    49  -0.03150  1.0 3.0
   37    33    46    44  -0.28300  1.0 1.0
   37    33    46    44   0.26700 -1.0 2.0
   37    33    46    44  -0.63300  1.0 3.0
   37    33    46    47   0.00000  1.0 1.0
   37    33    46    48   0.67800  1.0 1.0
   37    33    46    48   0.47050 -1.0 2.0
   37    33    46    48  -0.62500  1.0 3.0
   37    39    42    43   0.09700  1.0 1.0
   37    39    42    43   0.15600 -1.0 2.0
   37    39    42    43  -0.50800  1.0 3.0
   37    39   -42    44  -0.28300  1.0 1.0
   37    39   -42    44   0.26700 -1.0 2.0
   37    39   -42    44  -0.63300  1.0 3.0
   38    37    39    40   0.00000  1.0 1.0
   38    37    39    41   0.33100  1.0 3.0
   38    37    39    42   0.00000  1.0 1.0
   39    42    44    45   7.00000 -1.0 2.0
   39    42    44    46   7.00000 -1.0 2.0
   40    39    42    43   0.09700  1.0 1.0
   40    39    42    43   0.15600 -1.0 2.0
   40    39    42    43  -0.50800  1.0 3.0
   40    39    42    44   0.39000  1.0 1.0
   40    39    42    44  -0.05800 -1.0 2.0
   40    39    42    44  -0.55150  1.0 3.0
   41    39    42    43   0.00000  1.0 1.0
   41    39    42    44   0.00000  1.0 1.0
   42    44   -46    33  -0.28300  1.0 1.0
   42    44   -46    33   0.26700 -1.0 2.0
   42    44   -46    33  -0.63300  1.0 3.0
   42    44    46    47   0.00000  1.0 1.0
   42    44    46    48   0.67800  1.0 1.0
   42    44    46    48   0.47050 -1.0 2.0
   42    44    46    48  -0.62500  1.0 3.0
   43    42    44    45   7.00000 -1.0 2.0
   43    42    44    46   7.00000 -1.0 2.0
   44    46    48    49  -0.07800  1.0 1.0
   44    46    48    49  -0.21500 -1.0 2.0
   44    46    48    49  -0.03150  1.0 3.0
   45    44    46    33   0.00000  1.0 1.0
   45    44    46    47   0.33100  1.0 3.0
   45    44    46    48   0.00000  1.0 1.0
   46    33    37    38   7.00000 -1.0 2.0
   46    33   -37    39   7.00000 -1.0 2.0
   47    46    48    49   0.19450  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
   35    30    34    36  10.50000 -1.0 2.0
   29    46    33    37   1.10000 -1.0 2.0
   39    38    37    33   1.10000 -1.0 2.0
   39    43    42    44   1.10000 -1.0 2.0
   46    45    44    42   1.10000 -1.0 2.0
END
