* LIGAND DATABASE FILE (OPLS2005)
*
001      57    58    100    160     298
    1     0 S   NP   _N1_     1    28.71433    96.81161   -23.22662
    2     1 S   H    _HN1     2     1.02949    69.08160    16.90171
    3     1 S   H    _H1_     3     1.02829    41.68156   171.33125
    4     1 S   H    _H2_     4     1.02785   104.23789   -87.63084
    5     1 S   CT   _CA1     5     1.50108   140.91065   113.88849
    6     5 S   HC   _HA1     6     1.09573   105.19718    96.05759
    7     5 S   CO3  _C1_     7     1.53785   112.45804   -24.18156
    8     7 S   O2Z  _O11     8     1.26371   115.00676   -42.79777
    9     7 S   O2Z  _O12     9     1.26239   114.94233   136.33861
   10     5 S   CT   _CB1    10     1.53080   107.42517  -145.96413
   11    10 S   HC   HB11    11     1.09833   109.36567   -49.80873
   12    10 S   HC   HB12    12     1.09813   110.45345    66.79741
   13    10 S   CT   _CG1    13     1.52992   112.60348  -170.78712
   14    13 S   HC   HG11    14     1.09582   110.63289   -65.70478
   15    13 S   HC   HG12    15     1.09671   109.78464    53.52610
   16    13 S   C    _CD1    16     1.51801   112.22270   173.97696
   17    16 S   O    _OE1    17     1.22730   123.28875     7.06666
   18    16 S   N    _N2_    18     1.38658   111.67632  -173.06002
   19    18 S   H    _HN2    19     1.01585   118.93125     1.71418
   20    18 S   CT1  _CA2    20     1.46193   123.37050   177.19523
   21    20 S   HC   _HA2    21     1.09739   109.37749     1.83387
   22    20 S   C    _C2_    22     1.53557   108.56262  -113.60002
   23    22 S   O    _O2_    23     1.23054   122.28077  -148.01713
   24    20 S   CT   _CB2    32     1.53388   111.61137   123.89334
   25    24 S   HC   HB21    33     1.09530   109.91300    56.23779
   26    24 S   HC   HB22    34     1.09417   109.77453   175.24115
   27    22 S   N    _N3_    24     1.38327   113.68803    39.43252
   28    27 S   H    _HN3    25     1.01587   119.58695    -3.32655
   29    24 S   S    _SG2    35     1.82837   111.34920   -65.13012
   30    27 S   CT   _CA3    26     1.45286   123.22148   177.14707
   31    30 S   HC   HA31    27     1.09548   107.51202   -64.62693
   32    30 S   HC   HA32    28     1.09556   107.98646    51.81621
   33    29 S   CT   _C11    36     1.84005   100.61758   170.95115
   34    30 S   CO3  _C3_    29     1.52962   114.06670   173.81135
   35    34 S   O2Z  _O31    30     1.26377   116.06255    -0.63396
   36    34 S   O2Z  _O32    31     1.26426   114.41543   179.42495
   37    33 S   CO4  _C10    37     1.52406   106.59831  -174.88362
   38    37 S   O    _O33    38     1.22852   122.49318    95.67653
   39    33 S   CT   _C12    49     1.52003   114.26990    64.02055
   40    39 S   HC   _H5_    50     1.09536   111.27106   -57.50946
   41    39 S   HC   _H6_    51     1.09857   110.41095  -174.27252
   42    33 S   OH   _O35    56     1.42221   110.56253   -58.36160
   43    42 S   HO   _H7_    57     0.97308   106.60317   -49.87813
   44    37 S   CA   _C9_    39     1.48614   117.49863   -82.48636
   45    44 S   CA   _C4_    40     1.40161   118.50458   165.14061
   46    45 S   HA   _H3_    41     1.08695   120.69450     1.12848
   47    45 S   CA   _C5_    42     1.39264   119.53593  -178.16048
   48    47 S   CA   _C6_    43     1.39042   120.81876     0.04423
   49    48 S   HA   _H4_    44     1.08692   120.16372   179.86012
   50    47 S   OH   _O37    54     1.36628   121.05754   179.80119
   51    50 S   HO   _H9_    55     0.97251   108.75723     0.12511
   52    48 S   CA   _C7_    45     1.39547   119.58546    -0.32445
   53    44 S   CA   _C8_    46     1.40310   121.10871   -13.58424
   54    52 S   OH   _O36    52     1.36905   115.89820  -179.55765
   55    54 S   HO   _H8_    53     0.97387   109.00213  -178.50328
   56    53 S   CO4  _C13    47     1.48582   119.66442    -3.50928
   57    56 S   O    _O34    48     1.22713   120.86940   173.44536
  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
  12   2   1   1  13   5   9   5   4   3   1  10   9   4   7   8
   4   2   1   5   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    39    42    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    44    56    39    40    41    42    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    44    45    53    56    57    39    40    41    42    43  
   35    36  
   36  
    0  
   38    44    45    46    47    52    53    56    39    40    41    42    43  
   44    45    53    39    42  
   40    41    42    43    44    52    53    56    57  
   41    42    53    56    57  
   42    53    56    57  
   43    44    56  
    0  
   45    46    47    48    52    53    56    57    54    50  
   46    47    48    49    52    53    56    50    51  
   47    48    53    50  
   48    49    52    53    54    50    51  
   49    52    53    56    54    55    50    51  
   52    53    54    50  
   51    52  
    0  
   53    56    57    54    55  
   56    57    54    55  
   55    56  
    0  
   57  
    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   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   43   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   44   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   50   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   51   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   52   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   53   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   54   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   55   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   56   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
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  1.522
   33    39   268.000  1.529
   33    42   320.000  1.410
   37    38   570.000  1.229
   37    44   310.000  1.470
   44    45   469.000  1.400
   44    53   469.000  1.400
   45    46   367.000  1.080
   45    47   469.000  1.400
   47    48   469.000  1.400
   47    50   450.000  1.364
   48    49   367.000  1.080
   48    52   469.000  1.400
   52    53   469.000  1.400
   52    54   450.000  1.364
   53    56   310.000  1.470
   56    57   570.000  1.229
   56    39   317.000  1.522
   39    40   340.000  1.090
   39    41   340.000  1.090
   54    55   553.000  0.945
   50    51   553.000  0.945
   42    43   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  110.18000
   29    33    39    75.00000  111.63000
   29    33    42    85.00000  114.68000
   33    37    38    80.00000  120.40000
   33    37    44    65.00000  115.47100
   33    39    56    63.00000  111.10000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    42    43    55.00000  108.50000
   37    44    45    60.00000  119.52600
   37    44    53    60.00000  119.52600
   44    37    38    75.00000  123.78400
   44    45    46    35.00000  120.00000
   44    45    47    63.00000  120.00000
   44    53    52    63.00000  120.00000
   44    53    56    60.00000  119.52600
   45    47    48    63.00000  120.00000
   45    47    50    70.00000  120.00000
   47    45    46    35.00000  120.00000
   47    48    49    35.00000  120.00000
   47    48    52    63.00000  120.00000
   47    50    51    35.00000  113.00000
   48    52    53    63.00000  120.00000
   48    52    54    70.00000  120.00000
   52    48    49    35.00000  120.00000
   52    53    56    60.00000  119.52600
   52    54    55    35.00000  113.00000
   53    44    45    63.00000  120.00000
   53    56    57    75.00000  123.78400
   53    56    39    65.00000  115.47100
   56    39    40    35.00000  109.50000
   56    39    41    35.00000  109.50000
   39    33    37    63.00000  111.10000
   39    56    57    80.00000  120.40000
   41    39    40    33.00000  107.80000
   54    52    53    70.00000  120.00000
   50    47    48    70.00000  120.00000
   42    33    37    90.00000  109.61100
   42    33    39    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   0.01700  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    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
   24    29    33    42   0.13850  1.0 1.0
   24    29    33    42  -1.34450 -1.0 2.0
   24    29    33    42   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   0.30150 -1.0 2.0
   29    33    37    44   0.65300  1.0 1.0
   29    33    37    44  -0.03850 -1.0 2.0
   29    33    37    44   0.33900  1.0 3.0
   29    33    39    56   0.56750  1.0 1.0
   29    33    39    56  -0.07550 -1.0 2.0
   29    33    39    56   0.20000  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    42    43   0.35600  1.0 1.0
   29    33    42    43  -0.10750 -1.0 2.0
   29    33    42    43  -0.54400  1.0 3.0
   33    37    44    45   2.26350  1.0 1.0
   33    37    44    45   0.76750 -1.0 2.0
   33    37    44    45   0.22500  1.0 3.0
   33    37    44    53   2.26350  1.0 1.0
   33    37    44    53   0.76750 -1.0 2.0
   33    37    44    53   0.22500  1.0 3.0
   37    33    39    56   0.11950  1.0 1.0
   37    33    39    56   0.20300 -1.0 2.0
   37    33    39    56  -0.70800  1.0 3.0
   37    33    39    40  -0.11250  1.0 3.0
   37    33    39    41  -0.11250  1.0 3.0
   37    33    42    43   0.91850  1.0 1.0
   37    33    42    43   0.57950  1.0 3.0
   37    44    45    46   3.62500 -1.0 2.0
   37    44    45    47   3.62500 -1.0 2.0
   37    44    53    52   3.62500 -1.0 2.0
   37    44   -53    56   3.62500 -1.0 2.0
   38    37    44    45   1.05000 -1.0 2.0
   38    37    44    53   1.05000 -1.0 2.0
   44    45    47    48   3.62500 -1.0 2.0
   44    45    47    50   3.62500 -1.0 2.0
   44    53    56    57   1.05000 -1.0 2.0
   44    53    56    39   2.26350  1.0 1.0
   44    53    56    39   0.76750 -1.0 2.0
   44    53    56    39   0.22500  1.0 3.0
   45    44    53    52   3.62500 -1.0 2.0
   45    44    53    56   3.62500 -1.0 2.0
   45    47    48    49   3.62500 -1.0 2.0
   45    47   -48    52   3.62500 -1.0 2.0
   45    47    50    51   0.84100 -1.0 2.0
   46    45    47    48   3.62500 -1.0 2.0
   46    45    47    50   3.62500 -1.0 2.0
   47    48    52    53   3.62500 -1.0 2.0
   47    48    52    54   3.62500 -1.0 2.0
   48    47    50    51   0.84100 -1.0 2.0
   48    52   -53    44   3.62500 -1.0 2.0
   48    52    53    56   3.62500 -1.0 2.0
   48    52    54    55   0.84100 -1.0 2.0
   49    48    52    53   3.62500 -1.0 2.0
   49    48    52    54   3.62500 -1.0 2.0
   52    53    56    57   1.05000 -1.0 2.0
   52    53    56    39   2.26350  1.0 1.0
   52    53    56    39   0.76750 -1.0 2.0
   52    53    56    39   0.22500  1.0 3.0
   53    44    45    46   3.62500 -1.0 2.0
   53    44   -45    47   3.62500 -1.0 2.0
   53    52    54    55   0.84100 -1.0 2.0
   53    56   -39    33   0.05850 -1.0 2.0
   53    56   -39    33   0.17250  1.0 3.0
   53    56    39    40   0.00000  1.0 1.0
   53    56    39    41   0.00000  1.0 1.0
   57    56    39    33   0.30150 -1.0 2.0
   57    56    39    40   0.00000  1.0 1.0
   57    56    39    41   0.00000  1.0 1.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33   -37    44   0.05850 -1.0 2.0
   39    33   -37    44   0.17250  1.0 3.0
   39    33    42    43  -0.11600  1.0 1.0
   39    33    42    43  -0.09450 -1.0 2.0
   39    33    42    43   0.21250  1.0 3.0
   54    52    53    44   3.62500 -1.0 2.0
   54    52    53    56   3.62500 -1.0 2.0
   50    47    48    49   3.62500 -1.0 2.0
   50    47    48    52   3.62500 -1.0 2.0
   42    33    37    38   0.30150 -1.0 2.0
   42    33    37    44   0.65300  1.0 1.0
   42    33    37    44  -0.03850 -1.0 2.0
   42    33    37    44   0.33900  1.0 3.0
   42    33    39    56  -0.09450  1.0 1.0
   42    33    39    56  -1.12950 -1.0 2.0
   42    33    39    56   0.54000  1.0 3.0
   42    33    39    40   0.23400  1.0 3.0
   42    33    39    41   0.23400  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    44    37    38  10.50000 -1.0 2.0
   45    53    44    37   4.00000 -1.0 2.0
   47    46    45    44   1.10000 -1.0 2.0
   48    50    47    45   4.00000 -1.0 2.0
   52    49    48    47   1.10000 -1.0 2.0
   53    54    52    48   4.00000 -1.0 2.0
   52    56    53    44   4.00000 -1.0 2.0
   53    39    56    57  10.50000 -1.0 2.0
END
