* LIGAND DATABASE FILE (OPLS2005)
*
001      52    52     90    140     268
    1     0 S   NP   _N1_     1    28.80956    96.34730   -23.23499
    2     1 S   H    _HN1     2     1.02789   105.57124   -94.39779
    3     1 S   H    _H1_     3     1.02949    71.39866    10.16787
    4     1 S   H    _H2_     4     1.02828    38.73855   166.26835
    5     1 S   CT   _CA1     5     1.50109   138.60560   110.23631
    6     5 S   HC   _HA1     6     1.09572   105.18433    92.93808
    7     5 S   CO3  _C1_     7     1.53783   112.51752   -27.29996
    8     7 S   O2Z  _O11     8     1.26372   115.00489   -41.44067
    9     7 S   O2Z  _O12     9     1.26241   114.95305   137.71654
   10     5 S   CT   _CB1    10     1.53080   107.42919  -149.04778
   11    10 S   HC   HB11    11     1.09835   109.36856   -49.43613
   12    10 S   HC   HB12    12     1.09812   110.44812    67.17782
   13    10 S   CT   _CG1    13     1.52999   112.61179  -170.39360
   14    13 S   HC   HG11    14     1.09576   110.67768   -66.34463
   15    13 S   HC   HG12    15     1.09672   109.73660    52.88881
   16    13 S   C    _CD1    16     1.51800   112.17631   173.37889
   17    16 S   O    _OE1    17     1.22734   123.26008     9.34039
   18    16 S   N    _N2_    18     1.38656   111.70328  -170.78143
   19    18 S   H    _HN2    19     1.01577   118.93872     1.76791
   20    18 S   CT1  _CA2    20     1.46220   123.40555   176.94713
   21    20 S   HC   _HA2    21     1.09739   109.34159     4.63802
   22    20 S   C    _C2_    22     1.53632   108.72822  -110.81008
   23    22 S   O    _O2_    23     1.23066   122.26020  -148.88060
   24    20 S   CT   _CB2    32     1.53390   111.53326   126.68909
   25    24 S   HC   HB21    33     1.09525   109.81746    55.91064
   26    24 S   HC   HB22    34     1.09425   109.79747   175.02173
   27    22 S   N    _N3_    24     1.38321   113.78369    38.62579
   28    27 S   H    _HN3    25     1.01564   119.60338    -3.26992
   29    24 S   S    _SG2    35     1.82818   111.32133   -65.54534
   30    27 S   CT   _CA3    26     1.45288   123.26338   177.16697
   31    30 S   HC   HA31    27     1.09547   107.51036   -64.76314
   32    30 S   HC   HA32    28     1.09555   107.99629    51.69197
   33    29 S   CT   _C8_    36     1.85243   100.78095   168.36609
   34    30 S   CO3  _C3_    29     1.52972   114.04315   173.68882
   35    34 S   O2Z  _O31    30     1.26383   116.06471    -0.61771
   36    34 S   O2Z  _O32    31     1.26426   114.42071   179.44257
   37    33 S   CM   _C7_    37     1.51626   107.27286  -174.34625
   38    37 S   HC   _H6_    38     1.08808   117.74383    40.42415
   39    33 S   OH   _O34    51     1.43119   109.75205   -59.81589
   40    39 S   HO   _H8_    52     0.97207   106.46426   -42.76177
   41    37 S   CM   _C6_    39     1.34393   122.65353  -141.53846
   42    41 S   CM   _C5_    40     1.44409   120.82702    -1.15267
   43    42 S   HC   _H5_    41     1.08545   119.08363  -168.48587
   44    41 S   CO3  _C10    48     1.54350   121.27170  -178.91195
   45    44 S   O2Z  _O36    49     1.26577   115.82140  -158.69555
   46    44 S   O2Z  _O35    50     1.26583   115.82744    21.10430
   47    42 S   CM   _C4_    42     1.34012   121.33667    11.81346
   48    47 S   HC   _H4_    43     1.08596   119.17521   178.15708
   49    33 S   CT   _C9_    44     1.56157   110.99126    62.11027
   50    49 S   HC   _H3_    45     1.09810   110.44567    29.51288
   51    49 S   OH   _O33    46     1.42926   110.34783   -88.84680
   52    51 S   HO   _H7_    47     0.97215   107.80707   176.52368
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  13   2   1   1  13   5   6   1   8   9   4   3   1   1   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    49    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    47    49    50    51    39    40  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    47    48    49    50    51    52    44    39    40  
   35    36  
   36  
    0  
   38    41    42    43    47    49    50    51    44    45    46    39    40  
   41    42    49    44    39  
   40    41    47    49    50    51  
   49  
   42    43    47    48    49    44    45    46  
   43    47    48    49    50    51    44    45    46  
   47    48    49    44  
   45    46    47  
   46  
    0  
   48    49    50    51    52  
   49    50    51  
   50    51    52  
   51    52  
   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  -0.335000   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   0.432500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   40   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   41   3.5500   0.0760  -0.310300   2.0020   1.7750   0.023028004  -0.852763146
   42   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   43   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   44   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   47   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   48   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   222.000  1.810
   33    37   317.000  1.510
   33    49   268.000  1.529
   33    39   320.000  1.410
   37    38   340.000  1.080
   37    41   549.000  1.340
   41    42   380.000  1.444
   41    44   230.000  1.545
   42    43   340.000  1.080
   42    47   549.000  1.340
   47    48   340.000  1.080
   47    49   317.000  1.510
   49    50   340.000  1.090
   49    51   320.000  1.410
   51    52   553.000  0.945
   44    45   656.000  1.250
   44    46   656.000  1.250
   39    40   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    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    49    75.00000  111.63000
   29    33    39    85.00000  114.68000
   33    37    38    35.00000  117.00000
   33    37    41    70.00000  124.00000
   33    49    47    70.00000  112.02700
   33    49    50    37.50000  110.70000
   33    49    51    50.00000  109.50000
   33    39    40    55.00000  108.50000
   37    41    42    70.00000  123.01800
   37    41    44    55.00000  124.75400
   41    37    38    35.00000  120.00000
   41    42    43    35.00000  120.00000
   41    42    47    70.00000  123.01800
   41    44    45    85.00000  113.83300
   41    44    46    85.00000  113.83300
   42    47    48    35.00000  120.00000
   42    47    49    70.00000  124.00000
   47    42    43    35.00000  120.00000
   47    49    50    35.00000  109.50000
   47    49    51    90.00000  110.39200
   49    33    37    70.00000  112.02700
   49    47    48    35.00000  117.00000
   49    51    52    55.00000  108.50000
   51    49    50    35.00000  109.50000
   44    41    42    55.00000  124.75400
   46    44    45    80.00000  126.00000
   39    33    37    90.00000  110.39200
   39    33    49    50.00000  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   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    49   0.01700  1.0 1.0
   24    29    33    49  -0.23550 -1.0 2.0
   24    29    33    49   0.21350  1.0 3.0
   24    29    33    39   0.13850  1.0 1.0
   24    29    33    39  -1.34450 -1.0 2.0
   24    29    33    39   0.57400  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.00000  1.0 1.0
   29    33    37    41   0.42700  1.0 1.0
   29    33    37    41  -0.70350 -1.0 2.0
   29    33    37    41  -0.43150  1.0 3.0
   29    33    49    47   0.56750  1.0 1.0
   29    33    49    47  -0.07550 -1.0 2.0
   29    33    49    47   0.20000  1.0 3.0
   29    33    49    50   0.15000  1.0 3.0
   29    33    49    51   0.56750  1.0 1.0
   29    33    49    51  -0.07550 -1.0 2.0
   29    33    49    51   0.20000  1.0 3.0
   29    33    39    40   0.35600  1.0 1.0
   29    33    39    40  -0.10750 -1.0 2.0
   29    33    39    40  -0.54400  1.0 3.0
   33    37    41    42   7.00000 -1.0 2.0
   33    37    41    44   7.00000 -1.0 2.0
   33    49    51    52  -0.11600  1.0 1.0
   33    49    51    52  -0.09450 -1.0 2.0
   33    49    51    52   0.21250  1.0 3.0
   37    33    49    47   0.31000  1.0 1.0
   37    33    49    47   0.14700 -1.0 2.0
   37    33    49    47   0.07550  1.0 3.0
   37    33    49    50   0.15000  1.0 3.0
   37    33    49    51   1.05650  1.0 1.0
   37    33    49    51   0.15600 -1.0 2.0
   37    33    49    51   0.53150  1.0 3.0
   37    33    39    40  -0.07800  1.0 1.0
   37    33    39    40  -0.21500 -1.0 2.0
   37    33    39    40  -0.03150  1.0 3.0
   37    41    42    43  -0.18600  1.0 3.0
   37    41   -42    47   0.28850  1.0 1.0
   37    41   -42    47   2.61350 -1.0 2.0
   37    41   -42    47   0.78400  1.0 3.0
   37    41    44    45  -0.04000 -1.0 2.0
   37    41    44    45  -0.29050  1.0 3.0
   37    41    44    46  -0.04000 -1.0 2.0
   37    41    44    46  -0.29050  1.0 3.0
   38    37    41    42   7.00000 -1.0 2.0
   38    37    41    44   7.00000 -1.0 2.0
   41    42    47    48   7.00000 -1.0 2.0
   41    42    47    49   7.00000 -1.0 2.0
   42    41    44    45  -0.04000 -1.0 2.0
   42    41    44    45  -0.29050  1.0 3.0
   42    41    44    46  -0.04000 -1.0 2.0
   42    41    44    46  -0.29050  1.0 3.0
   42    47   -49    33   0.09850  1.0 1.0
   42    47   -49    33   0.15250 -1.0 2.0
   42    47   -49    33  -0.50650  1.0 3.0
   42    47    49    50   0.00000  1.0 1.0
   42    47    49    51   0.67800  1.0 1.0
   42    47    49    51   0.47050 -1.0 2.0
   42    47    49    51  -0.62500  1.0 3.0
   43    42    47    48   7.00000 -1.0 2.0
   43    42    47    49   7.00000 -1.0 2.0
   47    49    51    52  -0.07800  1.0 1.0
   47    49    51    52  -0.21500 -1.0 2.0
   47    49    51    52  -0.03150  1.0 3.0
   48    47    49    33   0.00000  1.0 1.0
   48    47    49    50   0.33100  1.0 3.0
   48    47    49    51   0.00000  1.0 1.0
   49    33    37    38   0.00000  1.0 1.0
   49    33   -37    41   0.09850  1.0 1.0
   49    33   -37    41   0.15250 -1.0 2.0
   49    33   -37    41  -0.50650  1.0 3.0
   49    33    39    40  -0.11600  1.0 1.0
   49    33    39    40  -0.09450 -1.0 2.0
   49    33    39    40   0.21250  1.0 3.0
   50    49    51    52   0.19450  1.0 3.0
   44    41    42    43   0.00000  1.0 1.0
   44    41    42    47  -0.18600  1.0 3.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    41   0.67800  1.0 1.0
   39    33    37    41   0.47050 -1.0 2.0
   39    33    37    41  -0.62500  1.0 3.0
   39    33    49    47   1.05650  1.0 1.0
   39    33    49    47   0.15600 -1.0 2.0
   39    33    49    47   0.53150  1.0 3.0
   39    33    49    50   0.23400  1.0 3.0
   39    33    49    51   3.75450  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
   35    30    34    36  10.50000 -1.0 2.0
   33    38    37    41   1.10000 -1.0 2.0
   42    44    41    37   1.10000 -1.0 2.0
   41    43    42    47   1.10000 -1.0 2.0
   49    48    47    42   1.10000 -1.0 2.0
   45    41    44    46  10.50000 -1.0 2.0
END
