* LIGAND DATABASE FILE (OPLS2005)
*
001      52    52     92    137     268
    1     0 S   NP   _N1_     1    28.83981    95.86575   -23.88720
    2     1 S   H    _HN1     2     1.02947    73.92046     5.87913
    3     1 S   H    _H1_     3     1.02828    34.27736   170.85806
    4     1 S   H    _H2_     4     1.02793   111.05904   -98.03847
    5     1 S   CT   _CA1     5     1.50121   131.95960   109.13212
    6     5 S   HC   _HA1     6     1.09574   105.16584    91.28539
    7     5 S   CO3  _C1_     7     1.53769   112.46543   -28.91939
    8     7 S   O2Z  _O11     8     1.26374   115.00505   -42.61035
    9     7 S   O2Z  _O12     9     1.26237   114.93981   136.42305
   10     5 S   CT   _CB1    10     1.53064   107.41169  -150.75384
   11    10 S   HC   HB11    11     1.09839   109.32551   -49.52073
   12    10 S   HC   HB12    12     1.09810   110.47808    67.07423
   13    10 S   CT   _CG1    13     1.53015   112.63314  -170.46550
   14    13 S   HC   HG11    14     1.09571   110.71137   -67.17962
   15    13 S   HC   HG12    15     1.09671   109.71077    52.06380
   16    13 S   C    _CD1    16     1.51812   112.04287   172.52940
   17    16 S   O    _OE1    17     1.22751   123.20679    11.33626
   18    16 S   N    _N2_    18     1.38651   111.80779  -168.67608
   19    18 S   H    _HN2    19     1.01578   118.97376     1.15487
   20    18 S   CT1  _CA2    20     1.46222   123.37802   176.53310
   21    20 S   HC   _HA2    21     1.09737   109.29378     6.89176
   22    20 S   C    _C2_    22     1.53663   108.80052  -108.58858
   23    22 S   O    _O2_    23     1.23077   122.25491  -148.67829
   24    20 S   CT   _CB2    32     1.53266   111.64324   128.90332
   25    24 S   HC   HB21    33     1.09617   110.15572    56.80550
   26    24 S   HC   HB22    34     1.09577   110.19431   175.36713
   27    22 S   N    _N3_    24     1.38315   113.84800    38.81659
   28    27 S   H    _HN3    25     1.01548   119.61873    -3.17453
   29    24 S   S    _SG2    35     1.82578   111.63344   -64.55178
   30    27 S   CT   _CA3    26     1.45286   123.28764   177.21393
   31    30 S   HC   HA31    27     1.09547   107.50523   -65.04551
   32    30 S   HC   HA32    28     1.09555   108.00950    51.41987
   33    29 S   CM   _C8_    36     1.75057    99.21680  -179.48414
   34    30 S   CO3  _C3_    29     1.52976   114.02738   173.42440
   35    34 S   O2Z  _O31    30     1.26385   116.06621    -0.46897
   36    34 S   O2Z  _O32    31     1.26421   114.42302   179.59314
   37    33 S   CM   _C7_    37     1.34712   119.50294    93.29244
   38    37 S   HC   _H8_    38     1.08704   120.68911     1.49894
   39    37 S   CM   _C6_    39     1.45083   122.05977  -178.24108
   40    39 S   Cl   Cl1_    40     1.73248   115.63607  -166.83940
   41    39 S   CM   _C5_    41     1.34965   121.41161    16.12213
   42    41 S   CT   _C10    42     1.52742   118.82717    -1.99733
   43    42 S   HC   _H4_    43     1.09941   105.80223    94.20804
   44    41 S   CT   _C4_    49     1.50556   125.14713   175.26757
   45    44 S   HC   _H5_    50     1.09487   110.26302   114.09588
   46    44 S   HC   _H6_    51     1.09268   113.69306    -6.52774
   47    44 S   HC   _H7_    52     1.09538   109.99615  -126.25605
   48    33 S   CT   _C9_    44     1.52736   118.94314   -84.66454
   49    48 S   OM   _O34    45     1.32847   106.95429   -88.64052
   50    48 S   HC   _H3_    46     1.10077   107.47795    40.07000
   51    42 S   OH   _O33    47     1.43152   110.98673  -151.81934
   52    51 S   HO   _H9_    48     0.97457   105.74358    92.83275
  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
  11   2   1   1   9   4  10   3  11  10   6   5   2   1   1   4
   2   1   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    48    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    42    48    49    50  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    40    41    42    43    48    49    50    51  
   35    36  
   36  
    0  
   38    39    40    41    42    48    49    50    44  
   39    40    41    48  
   40    41    42    43    48    51    44    45    46    47  
   41    42    44  
   42    43    48    49    50    51    52    44    45    46    47  
   43    48    49    50    51    52    44    45    46    47  
   48    49    50    51    52    44  
   45    46    47    48    51  
   46    47  
   47  
    0  
   49    50    51    52  
   50    51  
   51  
   52  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.175000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5500   0.0760   0.007500   2.0020   1.7750   0.023028004  -0.852763146
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   40   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   41   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   42   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   49   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   50   2.5000   0.0500   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   240.000  1.763
   33    37   549.000  1.340
   33    48   317.000  1.510
   37    38   340.000  1.080
   37    39   380.000  1.444
   39    40   300.000  1.725
   39    41   549.000  1.340
   41    42   317.000  1.510
   41    44   317.000  1.510
   42    43   340.000  1.090
   42    48   268.000  1.529
   42    51   320.000  1.410
   48    49   570.000  1.307
   48    50   340.000  1.090
   51    52   553.000  0.945
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   340.000  1.090
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    48    65.00000  117.37300
   33    37    38    35.00000  120.00000
   33    37    39    70.00000  123.01800
   33    48    42    70.00000  112.02700
   33    48    49    85.00000  110.90400
   33    48    50    35.00000  109.50000
   37    39    40    75.00000  121.50000
   37    39    41    70.00000  123.01800
   39    37    38    35.00000  120.00000
   39    41    42    70.00000  124.00000
   39    41    44    70.00000  124.00000
   41    39    40    75.00000  121.50000
   41    42    43    35.00000  109.50000
   41    42    48    70.00000  112.02700
   41    42    51    90.00000  110.39200
   41    44    45    35.00000  109.50000
   41    44    46    35.00000  109.50000
   41    44    47    35.00000  109.50000
   42    48    49    50.00000  109.50000
   42    48    50    37.50000  110.70000
   42    51    52    55.00000  108.50000
   48    33    37    70.00000  124.00000
   48    42    43    37.50000  110.70000
   50    48    49    45.00000  125.66300
   51    42    43    35.00000  109.50000
   51    42    48    50.00000  109.50000
   44    41    42    65.00000  117.92700
   46    44    45    33.00000  107.80000
   47    44    45    33.00000  107.80000
   47    44    46    33.00000  107.80000
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    48   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    48    42   0.09700  1.0 1.0
   29    33    48    42   0.15600 -1.0 2.0
   29    33    48    42  -0.50800  1.0 3.0
   29    33    48    49   0.09700  1.0 1.0
   29    33    48    49   0.15600 -1.0 2.0
   29    33    48    49  -0.50800  1.0 3.0
   29    33    48    50   0.00000  1.0 1.0
   33    37    39    40  -0.18600  1.0 3.0
   33    37    39    41   0.28850  1.0 1.0
   33    37    39    41   2.61350 -1.0 2.0
   33    37    39    41   0.78400  1.0 3.0
   37    33    48    42   0.09850  1.0 1.0
   37    33    48    42   0.15250 -1.0 2.0
   37    33    48    42  -0.50650  1.0 3.0
   37    33    48    49   0.39000  1.0 1.0
   37    33    48    49  -0.05800 -1.0 2.0
   37    33    48    49  -0.55150  1.0 3.0
   37    33    48    50   0.00000  1.0 1.0
   37    39   -41    42   7.00000 -1.0 2.0
   37    39    41    44   7.00000 -1.0 2.0
   38    37    39    40   0.00000  1.0 1.0
   38    37    39    41  -0.18600  1.0 3.0
   39    41    42    43   0.00000  1.0 1.0
   39    41    42    48   0.09850  1.0 1.0
   39    41    42    48   0.15250 -1.0 2.0
   39    41    42    48  -0.50650  1.0 3.0
   39    41    42    51   0.67800  1.0 1.0
   39    41    42    51   0.47050 -1.0 2.0
   39    41    42    51  -0.62500  1.0 3.0
   39    41    44    45   0.00000  1.0 1.0
   39    41    44    46   0.00000  1.0 1.0
   39    41    44    47   0.00000  1.0 1.0
   40    39    41    42   7.00000 -1.0 2.0
   40    39    41    44   7.00000 -1.0 2.0
   41    42   -48    33   0.31000  1.0 1.0
   41    42   -48    33   0.14700 -1.0 2.0
   41    42   -48    33   0.07550  1.0 3.0
   41    42    48    49   0.61850  1.0 1.0
   41    42    48    49  -0.22750 -1.0 2.0
   41    42    48    49   0.15300  1.0 3.0
   41    42    48    50   0.15000  1.0 3.0
   41    42    51    52  -0.07800  1.0 1.0
   41    42    51    52  -0.21500 -1.0 2.0
   41    42    51    52  -0.03150  1.0 3.0
   42    41    44    45   0.34800  1.0 3.0
   42    41    44    46   0.34800  1.0 3.0
   42    41    44    47   0.34800  1.0 3.0
   43    42    48    33   0.15000  1.0 3.0
   43    42    48    49   0.23400  1.0 3.0
   43    42    48    50   0.15000  1.0 3.0
   43    42    51    52   0.19450  1.0 3.0
   48    33    37    38   7.00000 -1.0 2.0
   48    33   -37    39   7.00000 -1.0 2.0
   48    42    51    52  -0.11600  1.0 1.0
   48    42    51    52  -0.09450 -1.0 2.0
   48    42    51    52   0.21250  1.0 3.0
   51    42    48    33   1.05650  1.0 1.0
   51    42    48    33   0.15600 -1.0 2.0
   51    42    48    33   0.53150  1.0 3.0
   51    42    48    49   3.69350  1.0 1.0
   51    42    48    49  -1.82950 -1.0 2.0
   51    42    48    50   0.23400  1.0 3.0
   44    41    42    43   0.34800  1.0 3.0
   44    41    42    48   0.46850  1.0 1.0
   44    41    42    48   0.08550 -1.0 2.0
   44    41    42    48   0.09800  1.0 3.0
   44    41    42    51   0.18000  1.0 1.0
   44    41    42    51   0.16450 -1.0 2.0
   44    41    42    51   0.04450  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    48    33    37   1.10000 -1.0 2.0
   39    38    37    33   1.10000 -1.0 2.0
   37    40    39    41   1.10000 -1.0 2.0
   42    44    41    39   1.10000 -1.0 2.0
END
