* LIGAND DATABASE FILE (OPLS2005)
*
001      56    57    104    163     297
    1     0 S   NP   _N1_     1    28.16032    96.31259   -22.52876
    2     1 S   H    _HN1     2     1.02948    79.35527   -18.33892
    3     1 S   H    _H1_     3     1.02830    32.31935   130.91037
    4     1 S   H    _H2_     4     1.02772   102.29822  -124.98672
    5     1 S   CT   _CA1     5     1.50188   137.84178    90.37791
    6     5 S   HC   _HA1     6     1.09579   105.16063    81.33415
    7     5 S   CO3  _C1_     7     1.53801   111.90972   -38.69218
    8     7 S   O2Z  _O11     8     1.26379   115.00207   -51.24867
    9     7 S   O2Z  _O12     9     1.26207   114.91108   127.12767
   10     5 S   CT   _CB1    10     1.53052   107.30560  -160.94432
   11    10 S   HC   HB11    11     1.09840   109.39708   -49.36106
   12    10 S   HC   HB12    12     1.09805   110.50648    67.20308
   13    10 S   CT   _CG1    13     1.53019   112.62640  -170.25555
   14    13 S   HC   HG11    14     1.09592   110.65440   -64.81114
   15    13 S   HC   HG12    15     1.09658   109.82246    54.40485
   16    13 S   C    _CD1    16     1.51884   111.93701   174.87348
   17    16 S   O    _OE1    17     1.22800   123.22707     8.52447
   18    16 S   N    _N2_    18     1.38417   111.93875  -171.87576
   19    18 S   H    _HN2    19     1.01888   119.05117     3.02563
   20    18 S   CT1  _CA2    20     1.45788   122.93829   178.87465
   21    20 S   HC   _HA2    21     1.09732   108.73808    28.56418
   22    20 S   C    _C2_    22     1.52942   107.24718   -88.61710
   23    22 S   O    _O2_    23     1.22963   123.15771   -27.97170
   24    20 S   CT   _CB2    32     1.53184   112.03360   151.65464
   25    24 S   HC   HB21    33     1.09452   109.81069    55.14843
   26    24 S   HC   HB22    34     1.09518   110.41893   173.43392
   27    22 S   N    _N3_    24     1.38537   112.51686   154.69469
   28    27 S   H    _HN3    25     1.01650   120.36428    -1.96025
   29    24 S   S    _SG2    35     1.82877   111.01622   -67.14760
   30    27 S   CT   _CA3    26     1.45353   122.44595   178.71458
   31    30 S   HC   HA31    27     1.09566   107.68559   -58.53052
   32    30 S   HC   HA32    28     1.09565   107.72224    57.79000
   33    29 S   CT   _C8_    36     1.85105   100.91285   151.36633
   34    30 S   CO3  _C3_    29     1.52884   114.35142   179.63309
   35    34 S   O2Z  _O31    30     1.26332   116.06952    -0.65252
   36    34 S   O2Z  _O32    31     1.26443   114.40973   179.36020
   37    33 S   CT1  _C7_    37     1.57649   114.25667   -67.75602
   38    37 S   HC   _H4_    38     1.09737   110.23019   102.08020
   39    33 S   CT   _C9_    51     1.54655   110.72843    58.10598
   40    39 S   HC   _H7_    52     1.09537   110.75657   173.38467
   41    39 S   HC   _H8_    53     1.09532   111.59165   -67.43265
   42    37 S   N4   _N4_    39     1.46623   102.09261  -142.75085
   43    37 S   CO3  _C11    48     1.54407   116.70189   -22.99733
   44    43 S   O2Z  _O37    49     1.26301   116.23204   -67.13945
   45    43 S   O2Z  _O36    50     1.26559   114.49485   112.68696
   46    39 S   CO4  _C10    54     1.51074   113.13201    55.57136
   47    46 S   O    _O35    55     1.22734   123.15674  -128.82879
   48    46 S   HC   _H9_    56     1.10333   116.07439    54.15313
   49    42 S   C4   _C6_    40     1.36219   126.02402   -88.58795
   50    49 S   O    _O33    41     1.20958   132.58692   -48.48644
   51    42 S   C4T  _C5_    45     1.46307   110.22274    24.35185
   52    51 S   HC   _H3_    46     1.09430   112.96234   106.49184
   53    49 S   C4T  _C4_    42     1.54017    91.13640   125.42901
   54    53 S   HC   _H5_    43     1.09273   114.03543   110.54922
   55    53 S   HC   _H6_    44     1.09254   114.04431  -121.39329
   56    33 S   OS   _O34    47     1.46938   109.40664   174.94681
  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
  17   2   1   1  15   8   9   5   4  11   5   1   1   3   1   1
   7   4   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    56    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    42    51    56    43    39    40    41    46  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    42    49    53    51    52    56    43    44    45    39    40    41    46    47    48  
   35    36  
   36  
    0  
   38    42    49    50    53    51    52    56    43    44    45    39    40    41    46  
   42    49    51    56    43    44    45    39  
   40    41    46    47    48    42    43    51    56  
   41    46    47    48    56  
   46    47    48    56  
   49    50    53    54    55    51    52    56    43    44    45  
   44    45    49    51    56  
   45  
    0  
   47    48    56  
   48  
    0  
   50    53    54    55    51    52    56  
   53    54    55    51  
   52    56    53    54    55  
   56    53    54    55  
   54    55    56  
   55    56  
   56  
    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  -0.316400   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   0.348900   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   3.5000   0.0660   0.040000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   42   3.2500   0.1700  -0.445000   1.8100   1.6000   0.054801302  -1.445846770
   43   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   46   3.7500   0.1050   0.450000   2.1120   1.8750   0.001000000  -0.126889456
   47   2.9600   0.2100  -0.450000   1.6780   1.4800   0.001000000  -0.126889456
   48   2.4200   0.0150   0.000000   1.3810   1.2100   0.008598240   0.268726247
   49   3.7500   0.1050   0.665000   1.9250   1.7000   0.001000000  -0.126889456
   50   2.9600   0.2100  -0.506500   1.5250   1.4250   0.001000000  -1.480495490
   51   3.5000   0.0660   0.222500   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.100000   1.3810   1.2100   0.008598240   0.268726247
   53   3.5000   0.0660  -0.156000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.9000   0.1400  -0.400000   1.7660   1.5600   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   268.000  1.529
   33    56   320.000  1.410
   33    39   268.000  1.529
   37    38   340.000  1.090
   37    42   337.000  1.449
   37    43   317.000  1.522
   42    49   440.000  1.369
   42    51   305.000  1.456
   49    50   930.000  1.212
   49    53   250.000  1.540
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    51   268.000  1.529
   51    52   340.000  1.090
   51    56   320.000  1.410
   43    44   656.000  1.250
   43    45   656.000  1.250
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    46   317.000  1.522
   46    47   570.000  1.229
   46    48   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    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  108.68000
   29    33    56    85.00000  114.68000
   29    33    39    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    42    80.00000  109.70000
   33    37    43    63.00000  111.10000
   33    56    51    60.00000  109.50000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    46    63.00000  111.10000
   37    42    49    50.00000  132.10000
   37    42    51    50.00000  132.70000
   37    43    44    70.00000  117.00000
   37    43    45    70.00000  117.00000
   42    37    38    35.00000  109.50000
   42    49    50    75.00000  131.60000
   42    49    53    95.00000   92.72400
   42    51    53   105.00000   87.49700
   42    51    52    50.00000  112.01000
   42    51    56    95.00000  111.00000
   49    53    54    40.00000  113.37500
   49    53    55    40.00000  113.37500
   49    53    51   100.00000   86.36000
   53    49    50    60.00000  136.58000
   53    51    52    37.50000  110.70000
   53    51    56    50.00000  109.50000
   55    53    54    33.00000  107.80000
   51    42    49   100.00000   93.00000
   51    53    54    37.50000  110.70000
   51    53    55    37.50000  110.70000
   56    33    37    50.00000  109.50000
   56    51    52    35.00000  109.50000
   43    37    38    35.00000  109.50000
   43    37    42    63.00000  110.10000
   45    43    44    80.00000  126.00000
   39    33    37    58.35000  112.70000
   39    33    56    50.00000  109.50000
   39    46    47    80.00000  120.40000
   39    46    48    35.00000  115.00000
   41    39    40    33.00000  107.80000
   46    39    40    35.00000  109.50000
   46    39    41    35.00000  109.50000
   48    46    47    35.00000  123.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    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   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    56   0.13850  1.0 1.0
   24    29    33    56  -1.34450 -1.0 2.0
   24    29    33    56   0.57400  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   0.15000  1.0 3.0
   29    33    37    42   0.71400  1.0 1.0
   29    33    37    42   0.04300 -1.0 2.0
   29    33    37    42   0.01450  1.0 3.0
   29    33    37    43  -2.17200  1.0 1.0
   29    33    37    43  -0.85700 -1.0 2.0
   29    33    56    51   0.14700  1.0 1.0
   29    33    56    51  -1.16150 -1.0 2.0
   29    33    56    51   0.48700  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    46   0.56750  1.0 1.0
   29    33    39    46  -0.07550 -1.0 2.0
   29    33    39    46   0.20000  1.0 3.0
   33    37    42    49   0.00000  1.0 1.0
   33    37   -42    51   0.00000  1.0 1.0
   33    37    43    44   0.00000  1.0 1.0
   33    37    43    45   0.00000  1.0 1.0
   33    39    46    47   0.30150 -1.0 2.0
   33    39    46    48   0.74550  1.0 1.0
   33    39    46    48  -0.00500 -1.0 2.0
   37    33   -56    51   0.06250  1.0 1.0
   37    33   -56    51  -0.01100 -1.0 2.0
   37    33   -56    51   0.28050  1.0 3.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    41   0.15000  1.0 3.0
   37    33    39    46  -0.84850  1.0 1.0
   37    33    39    46  -0.22800 -1.0 2.0
   37    33    39    46   0.29250  1.0 3.0
   37    42    49    50   3.00000 -1.0 2.0
   37    42    49    53   3.00000 -1.0 2.0
   37    42   -51    53   0.00000  1.0 1.0
   37    42    51    52   0.00000  1.0 1.0
   37    42   -51    56   0.00000  1.0 1.0
   38    37    42    49   0.00000  1.0 1.0
   38    37    42    51   0.00000  1.0 1.0
   38    37    43    44   0.00000  1.0 1.0
   38    37    43    45   0.00000  1.0 1.0
   42    37    43    44   0.00000  1.0 1.0
   42    37    43    45   0.00000  1.0 1.0
   42    49    53    54   0.00000  1.0 1.0
   42    49    53    55   0.00000  1.0 1.0
   42    49   -53    51   3.00000 -1.0 2.0
   42    51   -56    33  -2.37750  1.0 1.0
   42    51   -56    33  -0.08150 -1.0 2.0
   42    51   -56    33   0.59000  1.0 3.0
   49    42   -51    53   0.00000  1.0 1.0
   49    42    51    52   0.00000  1.0 1.0
   49    42    51    56   0.00000  1.0 1.0
   49    53   -51    42   3.00000 -1.0 2.0
   49    53   -51    52   0.15000  1.0 3.0
   49    53   -51    56  -0.09450  1.0 1.0
   49    53   -51    56  -1.12950 -1.0 2.0
   49    53   -51    56   0.54000  1.0 3.0
   50    49    53    54   0.00000  1.0 1.0
   50    49    53    55   0.00000  1.0 1.0
   50    49    53    51  -0.11250  1.0 1.0
   50    49    53    51   0.11400 -1.0 2.0
   50    49    53    51  -0.28950  1.0 3.0
   53    51    56    33   0.06250  1.0 1.0
   53    51    56    33  -0.01100 -1.0 2.0
   53    51    56    33   0.28050  1.0 3.0
   54    53   -51    42   0.15000  1.0 3.0
   54    53    51    52   0.15000  1.0 3.0
   54    53    51    56   0.15000  1.0 3.0
   55    53   -51    42   0.15000  1.0 3.0
   55    53    51    52   0.15000  1.0 3.0
   55    53    51    56   0.15000  1.0 3.0
   51    42   -49    50   3.00000 -1.0 2.0
   51    42   -49    53   3.00000 -1.0 2.0
   52    51    56    33   0.37050  1.0 3.0
   56    33    37    38   0.23400  1.0 3.0
   56    33   -37    42   1.12100  1.0 1.0
   56    33   -37    42  -0.16500 -1.0 2.0
   56    33    37    43  -3.35100  1.0 1.0
   56    33    37    43  -0.37050 -1.0 2.0
   56    33    37    43   0.22400  1.0 3.0
   56    33    39    40   0.23400  1.0 3.0
   56    33    39    41   0.23400  1.0 3.0
   56    33    39    46  -0.09450  1.0 1.0
   56    33    39    46  -1.12950 -1.0 2.0
   56    33    39    46   0.54000  1.0 3.0
   43    37    42    49   0.00000  1.0 1.0
   43    37    42    51   0.00000  1.0 1.0
   39    33    37    38   0.15000  1.0 3.0
   39    33    37    42   0.42250  1.0 1.0
   39    33    37    42  -0.48100 -1.0 2.0
   39    33    37    42   0.35650  1.0 3.0
   39    33    37    43  -0.84850  1.0 1.0
   39    33    37    43  -0.22800 -1.0 2.0
   39    33    37    43   0.29250  1.0 3.0
   39    33    56    51   0.06250  1.0 1.0
   39    33    56    51  -0.01100 -1.0 2.0
   39    33    56    51   0.28050  1.0 3.0
   40    39    46    47   0.00000  1.0 1.0
   40    39    46    48   0.00000  1.0 1.0
   41    39    46    47   0.00000  1.0 1.0
   41    39    46    48   0.00000  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
   51    49    42    37   1.00000 -1.0 2.0
   42    53    49    50  10.50000 -1.0 2.0
   44    37    43    45  10.50000 -1.0 2.0
   39    48    46    47  10.50000 -1.0 2.0
END
