* LIGAND DATABASE FILE (OPLS2005)
*
001      52    53     94    144     273
    1     0 S   NP   _N1_     1    28.19702    97.18033   -21.41771
    2     1 S   H    _HN1     2     1.02957    71.18369   -15.33324
    3     1 S   H    _H1_     3     1.02836    41.78907   132.49380
    4     1 S   H    _H2_     4     1.02777    99.74363  -121.51440
    5     1 S   CT   _CA1     5     1.50158   144.62372    83.63593
    6     5 S   HC   _HA1     6     1.09573   105.19274    91.71621
    7     5 S   CO3  _C1_     7     1.53766   112.26894   -28.46607
    8     7 S   O2Z  _O11     8     1.26375   114.98274   -44.80578
    9     7 S   O2Z  _O12     9     1.26216   114.92122   134.07858
   10     5 S   CT   _CB1    10     1.53069   107.39901  -150.37555
   11    10 S   HC   HB11    11     1.09835   109.32131   -49.81895
   12    10 S   HC   HB12    12     1.09815   110.43594    66.71372
   13    10 S   CT   _CG1    13     1.53062   112.73511  -170.82892
   14    13 S   HC   HG11    14     1.09584   110.59786   -65.28738
   15    13 S   HC   HG12    15     1.09656   109.85811    53.97265
   16    13 S   C    _CD1    16     1.51856   112.08656   174.35972
   17    16 S   O    _OE1    17     1.22787   123.19883     5.23098
   18    16 S   N    _N2_    18     1.38571   111.92362  -174.90553
   19    18 S   H    _HN2    19     1.01578   119.18496     3.57226
   20    18 S   CT1  _CA2    20     1.45835   122.62476   177.62051
   21    20 S   HC   _HA2    21     1.09743   108.77539    27.25842
   22    20 S   C    _C2_    22     1.53000   107.05000   -89.72008
   23    22 S   O    _O2_    23     1.22980   123.08480   -26.94408
   24    20 S   CT   _CB2    32     1.53324   112.45167   150.41836
   25    24 S   HC   HB21    33     1.09435   109.81898    56.22574
   26    24 S   HC   HB22    34     1.09374   109.30332   174.91747
   27    22 S   N    _N3_    24     1.38510   112.56320   155.68407
   28    27 S   H    _HN3    25     1.01653   120.34667    -1.85762
   29    24 S   S    _SG2    35     1.82581   110.88193   -65.73864
   30    27 S   CT   _CA3    26     1.45354   122.48115   178.68121
   31    30 S   HC   HA31    27     1.09566   107.78475   -56.48596
   32    30 S   HC   HA32    28     1.09563   107.62960    59.84224
   33    29 S   CT   _C7_    36     1.86382   101.98609   164.43648
   34    30 S   CO3  _C3_    29     1.52891   114.33555  -178.34933
   35    34 S   O2Z  _O31    30     1.26336   116.06126     0.73542
   36    34 S   O2Z  _O32    31     1.26441   114.41149  -179.30508
   37    33 S   CM   _C8_    37     1.49863   109.31729   -68.91456
   38    37 S   HC   _H7_    38     1.08224   123.78898    75.92425
   39    33 S   CO   _C10    49     1.54175   115.25118    66.79602
   40    39 S   HC   _H3_    50     1.09953   111.00928   177.92755
   41    37 S   CMA  _C9_    39     1.35255   111.80085  -102.67089
   42    41 S   OM   _O34    40     1.26128   127.73666   178.35325
   43    39 S   OH   _O36    51     1.42151   111.48313   -63.46351
   44    43 S   HO   _H8_    52     0.97186   106.83574  -160.16226
   45    41 S   OS   _O33    41     1.43532   108.32324    -2.37553
   46    33 S   CM   _C6_    42     1.50098   106.54928  -176.19131
   47    46 S   CM   _C5_    43     1.33805   123.54024   -94.45020
   48    47 S   HC   _H6_    44     1.08463   120.68944  -172.69408
   49    47 S   CT   _C4_    45     1.50389   120.06564    -0.69998
   50    49 S   HC   _H4_    46     1.09426   110.00924   123.05586
   51    49 S   HC   _H5_    47     1.09549   109.22589  -118.83960
   52    49 S   OS   _O35    48     1.43851   114.46737     1.82446
  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  11   5   4   3
  14   2   1   1  10   5  11   5   4   2   4   1   4   6   5   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    46    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    45    46    47    52    39    40    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    45    46    47    48    49    52    39    40    43    44  
   35    36  
   36  
    0  
   38    41    42    45    46    47    52    39    40    43  
   41    42    45    46    39  
   40    43    44    41    45    46    47    49    50    51    52  
   43    44    46    49    52  
   42    45    46    47  
   45    46  
   44    46    49    52  
   52  
   46    47    48    49  
   47    48    49    50    51    52  
   48    49    50    51    52  
   49    50    51    52  
   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   0.167500   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  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660   0.264700   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.1200   0.1700  -0.582700   1.7660   1.5600   0.021068034  -0.322181743
   44   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   45   2.8500   0.1400  -0.570000   1.5900   1.4000   0.020110767  -0.896042159
   46   3.5500   0.0760   0.085000   2.0020   1.7750   0.023028004  -0.852763146
   47   3.5500   0.0760  -0.184000   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   0.209000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   52   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
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    46   317.000  1.510
   33    39   250.000  1.527
   37    38   340.000  1.080
   37    41   465.000  1.376
   41    42   745.000  1.250
   41    45   440.000  1.360
   45    46   440.000  1.360
   46    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   340.000  1.090
   49    52   320.000  1.410
   52    39   320.000  1.380
   39    40   340.000  1.090
   39    43   380.000  1.407
   43    44   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    46    75.00000  112.20000
   29    33    39    75.00000  111.63000
   33    37    38    35.00000  117.00000
   33    37    41    70.00000  124.00000
   33    46    45    85.00000  112.85300
   33    46    47    70.00000  124.00000
   33    39    52    90.00000  108.56700
   33    39    40    45.00000  112.01100
   33    39    43    90.00000  110.19100
   37    41    42    65.00000  137.10300
   37    41    45    80.00000  120.01400
   41    37    38    40.00000  120.50800
   41    45    46    90.00000  114.05000
   45    41    42    65.00000  121.00000
   45    46    47    80.00000  120.01400
   46    33    37    70.00000  110.12100
   46    47    48    35.00000  120.00000
   46    47    49    70.00000  124.00000
   47    49    50    35.00000  109.50000
   47    49    51    35.00000  109.50000
   47    49    52    85.00000  110.90400
   49    47    48    35.00000  117.00000
   49    52    39    60.00000  109.50000
   51    49    50    33.00000  107.80000
   52    49    50    35.00000  109.50000
   52    49    51    35.00000  109.50000
   52    39    40    35.00000  109.50000
   52    39    43   110.00000  112.08000
   39    33    37    70.00000  112.02700
   39    33    46    70.00000  112.02700
   39    43    44    70.00000  107.92000
   43    39    40    60.00000  108.02500
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    46  -0.62250  1.0 1.0
   24    29    33    46  -0.38450 -1.0 2.0
   24    29    33    46   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    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    46    45   0.09700  1.0 1.0
   29    33    46    45   0.15600 -1.0 2.0
   29    33    46    45  -0.50800  1.0 3.0
   29    33    46    47   0.42700  1.0 1.0
   29    33    46    47  -0.70350 -1.0 2.0
   29    33    46    47  -0.43150  1.0 3.0
   29    33    39    52   0.56750  1.0 1.0
   29    33    39    52  -0.07550 -1.0 2.0
   29    33    39    52   0.20000  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    43   0.56750  1.0 1.0
   29    33    39    43  -0.07550 -1.0 2.0
   29    33    39    43   0.20000  1.0 3.0
   33    37    41    42   7.00000 -1.0 2.0
   33    37   -41    45   7.00000 -1.0 2.0
   33    46    47    48   7.00000 -1.0 2.0
   33    46    47    49   7.00000 -1.0 2.0
   33    39    43    44  -0.11600  1.0 1.0
   33    39    43    44  -0.09450 -1.0 2.0
   33    39    43    44   0.21250  1.0 3.0
   37    33   -46    45   0.09700  1.0 1.0
   37    33   -46    45   0.15600 -1.0 2.0
   37    33   -46    45  -0.50800  1.0 3.0
   37    33    46    47  -0.28300  1.0 1.0
   37    33    46    47   0.26700 -1.0 2.0
   37    33    46    47  -0.63300  1.0 3.0
   37    33    39    52   0.61850  1.0 1.0
   37    33    39    52  -0.22750 -1.0 2.0
   37    33    39    52   0.15300  1.0 3.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    43   1.05650  1.0 1.0
   37    33    39    43   0.15600 -1.0 2.0
   37    33    39    43   0.53150  1.0 3.0
   37    41   -45    46   2.00000 -1.0 2.0
   38    37    41    42   7.00000 -1.0 2.0
   38    37    41    45   7.00000 -1.0 2.0
   41    45   -46    33   2.00000 -1.0 2.0
   41    45    46    47   2.00000 -1.0 2.0
   42    41    45    46   2.00000 -1.0 2.0
   45    46    47    48   7.00000 -1.0 2.0
   45    46    47    49   7.00000 -1.0 2.0
   46    33    37    38   0.00000  1.0 1.0
   46    33   -37    41  -0.28300  1.0 1.0
   46    33   -37    41   0.26700 -1.0 2.0
   46    33   -37    41  -0.63300  1.0 3.0
   46    33    39    52   0.61850  1.0 1.0
   46    33    39    52  -0.22750 -1.0 2.0
   46    33    39    52   0.15300  1.0 3.0
   46    33    39    40   0.15000  1.0 3.0
   46    33    39    43   1.05650  1.0 1.0
   46    33    39    43   0.15600 -1.0 2.0
   46    33    39    43   0.53150  1.0 3.0
   46    47    49    50   0.00000  1.0 1.0
   46    47    49    51   0.00000  1.0 1.0
   46    47   -49    52   0.39000  1.0 1.0
   46    47   -49    52  -0.05800 -1.0 2.0
   46    47   -49    52  -0.55150  1.0 3.0
   47    49    52    39  -0.77900  1.0 1.0
   47    49    52    39  -0.36900 -1.0 2.0
   47    49    52    39   0.40400  1.0 3.0
   48    47    49    50   0.33100  1.0 3.0
   48    47    49    51   0.33100  1.0 3.0
   48    47    49    52   0.00000  1.0 1.0
   49    52   -39    33   0.06250  1.0 1.0
   49    52   -39    33  -0.01100 -1.0 2.0
   49    52   -39    33   0.28050  1.0 3.0
   49    52    39    40   0.37050  1.0 3.0
   49    52    39    43  -0.81800  1.0 1.0
   50    49    52    39   0.37050  1.0 3.0
   51    49    52    39   0.37050  1.0 3.0
   52    39    43    44  -0.50000  1.0 1.0
   52    39    43    44  -0.73950 -1.0 2.0
   52    39    43    44   0.17150  1.0 3.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    41   0.09850  1.0 1.0
   39    33    37    41   0.15250 -1.0 2.0
   39    33    37    41  -0.50650  1.0 3.0
   39    33    46    45   0.09700  1.0 1.0
   39    33    46    45   0.15600 -1.0 2.0
   39    33    46    45  -0.50800  1.0 3.0
   39    33   -46    47   0.09850  1.0 1.0
   39    33   -46    47   0.15250 -1.0 2.0
   39    33   -46    47  -0.50650  1.0 3.0
   40    39    43    44   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
   33    38    37    41   1.10000 -1.0 2.0
   42    45    41    37   1.10000 -1.0 2.0
   33    45    46    47   1.10000 -1.0 2.0
   49    48    47    46   1.10000 -1.0 2.0
END
