* LIGAND DATABASE FILE (OPLS2005)
*
001      56    58    109    182     322
    1     0 S   NP   _N1_     1    29.12270    94.63876   -23.39547
    2     1 S   H    _HN1     2     1.02784   106.92131   -89.96089
    3     1 S   H    _H1_     3     1.02950    81.18375    16.66187
    4     1 S   H    _H2_     4     1.02830    28.12710   173.62434
    5     1 S   CT   _CA1     5     1.50112   132.07403   126.25511
    6     5 S   HC   _HA1     6     1.09572   105.20232    81.01688
    7     5 S   CO3  _C1_     7     1.53790   112.45263   -39.23491
    8     7 S   O2Z  _O11     8     1.26373   115.00379   -42.50972
    9     7 S   O2Z  _O12     9     1.26237   114.94760   136.62998
   10     5 S   CT   _CB1    10     1.53079   107.42840  -160.97949
   11    10 S   HC   HB11    11     1.09832   109.39519   -49.59363
   12    10 S   HC   HB12    12     1.09815   110.43661    67.01690
   13    10 S   CT   _CG1    13     1.52992   112.60413  -170.57198
   14    13 S   HC   HG11    14     1.09581   110.62439   -65.26033
   15    13 S   HC   HG12    15     1.09667   109.81198    53.98790
   16    13 S   C    _CD1    16     1.51778   112.21292   174.45458
   17    16 S   O    _OE1    17     1.22743   123.28571     6.57540
   18    16 S   N    _N2_    18     1.38656   111.69289  -173.70157
   19    18 S   H    _HN2    19     1.01596   119.02605     1.24568
   20    18 S   CT1  _CA2    20     1.46047   123.24857   177.72256
   21    20 S   HC   _HA2    21     1.09492   109.10557    -2.23870
   22    20 S   C    _C2_    22     1.53477   108.77197  -117.05928
   23    22 S   O    _O2_    23     1.23043   122.25798  -148.86622
   24    20 S   CT   _CB2    32     1.53289   111.79641   120.32074
   25    24 S   HC   HB21    33     1.09676   109.37786    61.45894
   26    24 S   HC   HB22    34     1.09428   111.22813   178.31043
   27    22 S   N    _N3_    24     1.38322   113.60621    38.68247
   28    27 S   H    _HN3    25     1.01607   119.54722    -3.55132
   29    24 S   S    _SG2    35     1.82909   114.78054   -57.87597
   30    27 S   CT   _CA3    26     1.45282   123.20801   176.93516
   31    30 S   HC   HA31    27     1.09549   107.51732   -64.52187
   32    30 S   HC   HA32    28     1.09557   107.97478    51.91530
   33    29 S   CT   _C6_    36     1.83143   101.07323   -64.54280
   34    33 S   HC   _H3_    37     1.09066   109.15231    56.29279
   35    30 S   CO3  _C3_    29     1.52960   114.07131   173.93777
   36    35 S   O2Z  _O31    30     1.26377   116.05528     0.31466
   37    35 S   O2Z  _O32    31     1.26427   114.42299  -179.62780
   38    33 S   CM   _C5_    38     1.50213   107.67749   175.23646
   39    38 S   HC   _H7_    39     1.08254   123.12408   -62.01825
   40    38 S   CM   _C4_    40     1.33669   113.64303   118.78457
   41    40 S   HC   _H6_    41     1.08111   124.11959   179.87646
   42    40 S   CT   _C8_    42     1.49274   112.15922     0.10279
   43    42 S   HC   _H5_    43     1.09692   109.44504  -116.51070
   44    33 S   CT   _C7_    44     1.54365   113.11909   -70.90979
   45    44 S   HC   _H4_    45     1.09773   111.22435     4.36107
   46    44 S   CT   _C12    46     1.57317   117.99425   132.04946
   47    46 S   Cl   Cl3_    47     1.75231   114.15502   -81.55921
   48    46 S   CM   _C11    48     1.51736   108.94033    50.22493
   49    48 S   Cl   Cl4_    49     1.69346   124.58260  -108.33674
   50    48 S   CM   _C10    50     1.33848   107.42263    70.27395
   51    50 S   Cl   Cl5_    51     1.69288   128.06765  -177.92227
   52    42 S   CT   _C9_    52     1.56575   117.74715   114.10993
   53    52 S   Cl   Cl6_    53     1.75227   113.92591    85.16080
   54    46 S   CT   _C13    54     1.56654   101.79167   154.10814
   55    54 S   Cl   Cl1_    55     1.80468   114.57572  -176.46681
   56    54 S   Cl   Cl2_    56     1.79419   114.93997    59.97883
  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   9   5   4   3
  14   7   2   1   1   9   4  10   4  13   7  11   5  10   7   8
   4   6   3   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    44    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    42    44    45    46  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    44    45    46    47    48    52    54  
   38    39    40    42    44    45    46  
   36    37  
   37  
    0  
   39    40    41    42    43    44    45    46    52  
   40    41    42    44  
   41    42    43    44    45    46    50    52    53    54  
   42    43    44    52  
   43    44    45    46    47    48    50    51    52    53    54    55    56  
   44    45    46    50    52    53    54  
   45    46    47    48    49    50    52    53    54    55    56  
   46    47    48    52    54  
   47    48    49    50    51    52    53    54    55    56  
   48    49    50    52    54    55    56  
   49    50    51    52    53    54    55    56  
   50    51    52    54  
   51    52    53    54    55    56  
   52    53    54  
   53    54    55    56  
   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  -0.335000   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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   41   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5000   0.0660  -0.060000   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   47   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   48   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   49   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   50   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   51   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   52   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   53   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   54   3.5000   0.0660   0.271600   1.9750   1.7500   0.005000000  -0.741685710
   55   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   56   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   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    34   340.000  1.090
   33    38   317.000  1.510
   33    44   268.000  1.529
   38    39   340.000  1.080
   38    40   549.000  1.340
   40    41   340.000  1.080
   40    42   317.000  1.510
   42    43   340.000  1.090
   42    44   268.000  1.529
   42    52   268.000  1.529
   44    45   340.000  1.090
   44    46   268.000  1.529
   46    47   245.000  1.781
   46    48   317.000  1.510
   46    54   268.000  1.529
   48    49   300.000  1.725
   48    50   549.000  1.340
   50    51   300.000  1.725
   50    52   317.000  1.510
   52    53   245.000  1.781
   52    54   268.000  1.529
   54    55   245.000  1.781
   54    56   245.000  1.781
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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    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    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    44    75.00000  111.63000
   33    38    39    35.00000  117.00000
   33    38    40    70.00000  124.00000
   33    44    42    58.35000  112.70000
   33    44    45    37.50000  110.70000
   33    44    46    58.35000  112.70000
   38    33    34    35.00000  109.50000
   38    40    41    35.00000  120.00000
   38    40    42    70.00000  124.00000
   40    38    39    35.00000  120.00000
   40    42    43    35.00000  109.50000
   40    42    44    70.00000  112.02700
   40    42    52    70.00000  112.02700
   42    40    41    35.00000  117.00000
   42    44    45    37.50000  110.70000
   42    44    46    58.35000  112.70000
   42    52    50    70.00000  112.02700
   42    52    53    69.00000  109.80000
   42    52    54    58.35000  112.70000
   44    33    34    37.50000  110.70000
   44    33    38    70.00000  112.02700
   44    42    43    37.50000  110.70000
   44    46    47    69.00000  109.80000
   44    46    48    70.00000  112.02700
   44    46    54    58.35000  112.70000
   46    44    45    37.50000  110.70000
   46    48    49    75.00000  111.02000
   46    48    50    70.00000  124.00000
   46    54    52    58.35000  112.70000
   46    54    55    69.00000  109.80000
   46    54    56    69.00000  109.80000
   48    46    47    75.00000  111.90500
   48    50    51    75.00000  121.50000
   48    50    52    70.00000  124.00000
   50    48    49    75.00000  121.50000
   50    52    53    75.00000  111.90500
   50    52    54    70.00000  112.02700
   52    42    43    37.50000  110.70000
   52    42    44    58.35000  112.70000
   52    50    51    75.00000  111.02000
   52    54    55    69.00000  109.80000
   52    54    56    69.00000  109.80000
   54    46    47    69.00000  109.80000
   54    46    48    70.00000  112.02700
   54    52    53    69.00000  109.80000
   56    54    55    80.00000  110.42200
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    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -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    35    36   0.00000  1.0 1.0
   27    30    35    37   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    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   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    34   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    44   0.01700  1.0 1.0
   24    29    33    44  -0.23550 -1.0 2.0
   24    29    33    44   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    38    39   0.00000  1.0 1.0
   29    33    38    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    44    42   0.44750  1.0 1.0
   29    33    44    42  -0.17800 -1.0 2.0
   29    33    44    42   0.20200  1.0 3.0
   29    33    44    45   0.15000  1.0 3.0
   29    33    44    46   0.44750  1.0 1.0
   29    33    44    46  -0.17800 -1.0 2.0
   29    33    44    46   0.20200  1.0 3.0
   33    38    40    41   7.00000 -1.0 2.0
   33    38   -40    42   7.00000 -1.0 2.0
   33    44    46    47   0.35600  1.0 1.0
   33    44    46    47  -0.14650 -1.0 2.0
   33    44    46    47   0.33350  1.0 3.0
   33    44    46    48   0.34400  1.0 1.0
   33    44    46    48   0.09450 -1.0 2.0
   33    44    46    48   0.11100  1.0 3.0
   33    44    46    54   0.56750  1.0 1.0
   33    44    46    54  -0.07550 -1.0 2.0
   33    44    46    54   0.20000  1.0 3.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    44    42   0.15000  1.0 3.0
   34    33    44    45   0.15000  1.0 3.0
   34    33    44    46   0.15000  1.0 3.0
   38    33   -44    42   0.34400  1.0 1.0
   38    33   -44    42   0.09450 -1.0 2.0
   38    33   -44    42   0.11100  1.0 3.0
   38    33    44    45   0.15000  1.0 3.0
   38    33    44    46   0.34400  1.0 1.0
   38    33    44    46   0.09450 -1.0 2.0
   38    33    44    46   0.11100  1.0 3.0
   38    40    42    43   0.00000  1.0 1.0
   38    40   -42    44   0.09850  1.0 1.0
   38    40   -42    44   0.15250 -1.0 2.0
   38    40   -42    44  -0.50650  1.0 3.0
   38    40    42    52   0.09850  1.0 1.0
   38    40    42    52   0.15250 -1.0 2.0
   38    40    42    52  -0.50650  1.0 3.0
   39    38    40    41   7.00000 -1.0 2.0
   39    38    40    42   7.00000 -1.0 2.0
   40    42   -44    33   0.34400  1.0 1.0
   40    42   -44    33   0.09450 -1.0 2.0
   40    42   -44    33   0.11100  1.0 3.0
   40    42    44    45   0.15000  1.0 3.0
   40    42    44    46   0.34400  1.0 1.0
   40    42    44    46   0.09450 -1.0 2.0
   40    42    44    46   0.11100  1.0 3.0
   40    42    52    50   0.31000  1.0 1.0
   40    42    52    50   0.14700 -1.0 2.0
   40    42    52    50   0.07550  1.0 3.0
   40    42    52    53   0.56750  1.0 1.0
   40    42    52    53  -0.07550 -1.0 2.0
   40    42    52    53   0.20000  1.0 3.0
   40    42    52    54   0.34400  1.0 1.0
   40    42    52    54   0.09450 -1.0 2.0
   40    42    52    54   0.11100  1.0 3.0
   41    40    42    43   0.33100  1.0 3.0
   41    40    42    44   0.00000  1.0 1.0
   41    40    42    52   0.00000  1.0 1.0
   42    44    46    47   0.35600  1.0 1.0
   42    44    46    47  -0.14650 -1.0 2.0
   42    44    46    47   0.33350  1.0 3.0
   42    44    46    48   0.34400  1.0 1.0
   42    44    46    48   0.09450 -1.0 2.0
   42    44    46    48   0.11100  1.0 3.0
   42    44   -46    54   0.56750  1.0 1.0
   42    44   -46    54  -0.07550 -1.0 2.0
   42    44   -46    54   0.20000  1.0 3.0
   42    52   -54    46   0.56750  1.0 1.0
   42    52   -54    46  -0.07550 -1.0 2.0
   42    52   -54    46   0.20000  1.0 3.0
   42    52    54    55   0.35600  1.0 1.0
   42    52    54    55  -0.14650 -1.0 2.0
   42    52    54    55   0.33350  1.0 3.0
   42    52    54    56   0.35600  1.0 1.0
   42    52    54    56  -0.14650 -1.0 2.0
   42    52    54    56   0.33350  1.0 3.0
   43    42    44    33   0.15000  1.0 3.0
   43    42    44    45   0.15000  1.0 3.0
   43    42    44    46   0.15000  1.0 3.0
   43    42    52    50   0.15000  1.0 3.0
   43    42    52    53   0.27000  1.0 3.0
   43    42    52    54   0.15000  1.0 3.0
   44    33    38    39   0.00000  1.0 1.0
   44    33   -38    40   0.09850  1.0 1.0
   44    33   -38    40   0.15250 -1.0 2.0
   44    33   -38    40  -0.50650  1.0 3.0
   44    42    52    50   0.34400  1.0 1.0
   44    42    52    50   0.09450 -1.0 2.0
   44    42    52    50   0.11100  1.0 3.0
   44    42    52    53   0.35600  1.0 1.0
   44    42    52    53  -0.14650 -1.0 2.0
   44    42    52    53   0.33350  1.0 3.0
   44    42   -52    54   0.56750  1.0 1.0
   44    42   -52    54  -0.07550 -1.0 2.0
   44    42   -52    54   0.20000  1.0 3.0
   44    46    48    49   0.09700  1.0 1.0
   44    46    48    49   0.15600 -1.0 2.0
   44    46    48    49  -0.50800  1.0 3.0
   44    46   -48    50   0.09850  1.0 1.0
   44    46   -48    50   0.15250 -1.0 2.0
   44    46   -48    50  -0.50650  1.0 3.0
   44    46   -54    52   0.56750  1.0 1.0
   44    46   -54    52  -0.07550 -1.0 2.0
   44    46   -54    52   0.20000  1.0 3.0
   44    46    54    55   0.35600  1.0 1.0
   44    46    54    55  -0.14650 -1.0 2.0
   44    46    54    55   0.33350  1.0 3.0
   44    46    54    56   0.35600  1.0 1.0
   44    46    54    56  -0.14650 -1.0 2.0
   44    46    54    56   0.33350  1.0 3.0
   45    44    46    47   0.27000  1.0 3.0
   45    44    46    48   0.15000  1.0 3.0
   45    44    46    54   0.15000  1.0 3.0
   46    48    50    51   7.00000 -1.0 2.0
   46    48   -50    52   7.00000 -1.0 2.0
   47    46    48    49   0.09700  1.0 1.0
   47    46    48    49   0.15600 -1.0 2.0
   47    46    48    49  -0.50800  1.0 3.0
   47    46    48    50   0.09700  1.0 1.0
   47    46    48    50   0.15600 -1.0 2.0
   47    46    48    50  -0.50800  1.0 3.0
   47    46    54    52   0.35600  1.0 1.0
   47    46    54    52  -0.14650 -1.0 2.0
   47    46    54    52   0.33350  1.0 3.0
   47    46    54    55   0.22500  1.0 1.0
   47    46    54    56   0.22500  1.0 1.0
   48    46   -54    52   0.34400  1.0 1.0
   48    46   -54    52   0.09450 -1.0 2.0
   48    46   -54    52   0.11100  1.0 3.0
   48    46    54    55   0.56750  1.0 1.0
   48    46    54    55  -0.07550 -1.0 2.0
   48    46    54    55   0.20000  1.0 3.0
   48    46    54    56   0.56750  1.0 1.0
   48    46    54    56  -0.07550 -1.0 2.0
   48    46    54    56   0.20000  1.0 3.0
   48    50   -52    42   0.09850  1.0 1.0
   48    50   -52    42   0.15250 -1.0 2.0
   48    50   -52    42  -0.50650  1.0 3.0
   48    50    52    53   0.09700  1.0 1.0
   48    50    52    53   0.15600 -1.0 2.0
   48    50    52    53  -0.50800  1.0 3.0
   48    50   -52    54   0.09850  1.0 1.0
   48    50   -52    54   0.15250 -1.0 2.0
   48    50   -52    54  -0.50650  1.0 3.0
   49    48    50    51   7.00000 -1.0 2.0
   49    48    50    52   7.00000 -1.0 2.0
   50    52   -54    46   0.34400  1.0 1.0
   50    52   -54    46   0.09450 -1.0 2.0
   50    52   -54    46   0.11100  1.0 3.0
   50    52    54    55   0.56750  1.0 1.0
   50    52    54    55  -0.07550 -1.0 2.0
   50    52    54    55   0.20000  1.0 3.0
   50    52    54    56   0.56750  1.0 1.0
   50    52    54    56  -0.07550 -1.0 2.0
   50    52    54    56   0.20000  1.0 3.0
   51    50    52    42   0.09700  1.0 1.0
   51    50    52    42   0.15600 -1.0 2.0
   51    50    52    42  -0.50800  1.0 3.0
   51    50    52    53   0.09700  1.0 1.0
   51    50    52    53   0.15600 -1.0 2.0
   51    50    52    53  -0.50800  1.0 3.0
   51    50    52    54   0.09700  1.0 1.0
   51    50    52    54   0.15600 -1.0 2.0
   51    50    52    54  -0.50800  1.0 3.0
   52    42    44    33   0.56750  1.0 1.0
   52    42    44    33  -0.07550 -1.0 2.0
   52    42    44    33   0.20000  1.0 3.0
   52    42    44    45   0.15000  1.0 3.0
   52    42   -44    46   0.56750  1.0 1.0
   52    42   -44    46  -0.07550 -1.0 2.0
   52    42   -44    46   0.20000  1.0 3.0
   53    52    54    46   0.35600  1.0 1.0
   53    52    54    46  -0.14650 -1.0 2.0
   53    52    54    46   0.33350  1.0 3.0
   53    52    54    55   0.22500  1.0 1.0
   53    52    54    56   0.22500  1.0 1.0
   54    46    48    49   0.09700  1.0 1.0
   54    46    48    49   0.15600 -1.0 2.0
   54    46    48    49  -0.50800  1.0 3.0
   54    46   -48    50   0.09850  1.0 1.0
   54    46   -48    50   0.15250 -1.0 2.0
   54    46   -48    50  -0.50650  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
   36    30    35    37  10.50000 -1.0 2.0
   33    39    38    40   1.10000 -1.0 2.0
   42    41    40    38   1.10000 -1.0 2.0
   46    49    48    50   1.10000 -1.0 2.0
   52    51    50    48   1.10000 -1.0 2.0
END
