* LIGAND DATABASE FILE (OPLS2005)
*
001      57    57    103    159     309
    1     0 S   NP   _N1_     1    28.96328    95.38635   -23.13205
    2     1 S   H    _HN1     2     1.02948    78.22824    11.82692
    3     1 S   H    _H1_     3     1.02831    32.36515   164.57380
    4     1 S   H    _H2_     4     1.02786   104.21252   -94.38771
    5     1 S   CT   _CA1     5     1.50100   136.50097   119.19770
    6     5 S   HC   _HA1     6     1.09571   105.21183    83.30888
    7     5 S   CO3  _C1_     7     1.53790   112.42951   -36.97909
    8     7 S   O2Z  _O11     8     1.26374   115.00142   -43.50678
    9     7 S   O2Z  _O12     9     1.26234   114.94513   135.66250
   10     5 S   CT   _CB1    10     1.53087   107.44623  -158.67548
   11    10 S   HC   HB11    11     1.09832   109.42694   -49.56588
   12    10 S   HC   HB12    12     1.09813   110.44021    67.05815
   13    10 S   CT   _CG1    13     1.52996   112.56958  -170.51937
   14    13 S   HC   HG11    14     1.09580   110.64747   -64.91978
   15    13 S   HC   HG12    15     1.09668   109.77888    54.30881
   16    13 S   C    _CD1    16     1.51788   112.21163   174.82653
   17    16 S   O    _OE1    17     1.22744   123.27363     7.55536
   18    16 S   N    _N2_    18     1.38652   111.69318  -172.75170
   19    18 S   H    _HN2    19     1.01589   118.99215     1.54965
   20    18 S   CT1  _CA2    20     1.46092   123.35382   177.73765
   21    20 S   HC   _HA2    21     1.09593   109.31105     0.77126
   22    20 S   C    _C2_    22     1.53528   108.81608  -114.27670
   23    22 S   O    _O2_    23     1.23054   122.22553  -149.15227
   24    20 S   CT   _CB2    32     1.53285   111.71291   123.17730
   25    24 S   HC   HB21    33     1.09649   109.72998    61.58806
   26    24 S   HC   HB22    34     1.09570   110.90336   179.01882
   27    22 S   N    _N3_    24     1.38314   113.69552    38.41960
   28    27 S   H    _HN3    25     1.01590   119.57586    -3.63863
   29    24 S   S    _SG2    35     1.82903   114.53295   -58.37263
   30    27 S   CT   _CA3    26     1.45281   123.22117   176.97192
   31    30 S   HC   HA31    27     1.09549   107.54938   -63.63610
   32    30 S   HC   HA32    28     1.09555   107.94652    52.80420
   33    29 S   CT   _C10    36     1.82790    99.80453   -64.80275
   34    33 S   HC   _H12    37     1.09354   108.19199   -48.05107
   35    33 S   HC   _H13    38     1.09364   107.53826    69.14629
   36    30 S   CO3  _C3_    29     1.52958   114.05560   174.77198
   37    36 S   O2Z  _O31    30     1.26380   116.05225    -0.49968
   38    36 S   O2Z  _O32    31     1.26423   114.41768   179.55194
   39    33 S   CT   _C5_    39     1.54298   111.67653  -170.76705
   40    39 S   HC   _H3_    40     1.09944   108.18465   -43.82829
   41    39 S   CT   _C4_    41     1.53808   112.33888    73.95467
   42    41 S   HC   _H7_    42     1.09443   111.73119   -47.40609
   43    41 S   HC   _H8_    43     1.09645   110.38657  -166.26806
   44    41 S   CO4  _C9_    44     1.51418   111.30589    74.69315
   45    44 S   O    _O33    45     1.22990   121.56516  -130.90952
   46    44 S   CT   _C8_    46     1.52083   115.80925    53.53885
   47    46 S   HC   _H6_    47     1.09624   107.23710    66.71413
   48    46 S   CT   _C7_    48     1.53140   110.27991   -53.24571
   49    48 S   HC   _H5_    49     1.09710   107.93912   172.65853
   50    46 S   OH   _O34    56     1.41608   111.42900  -175.78258
   51    50 S   HO   _H9_    57     0.97276   107.41894   -55.19654
   52    39 S   CT   _C6_    50     1.55102   111.61045  -161.11167
   53    52 S   HC   _H4_    51     1.09666   109.41580    49.22169
   54    48 S   OH   _O35    54     1.42650   109.87933   -71.36416
   55    54 S   HO   _H10    55     0.97262   107.56194  -172.58839
   56    52 S   OH   _O36    52     1.42946   108.99441   166.17766
   57    56 S   HO   _H11    53     0.97285   107.60514   -61.25364
  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   7   5   4   3
  12   5   4   2   1   1  14   8  11   5   4   9   4  10   6   9
   6   3   1   5   3   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    52  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    44    48    52    53    56  
   35    39    40    41    52  
   39    40    41    52  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    48    49    52    53    56    57    54  
   41    42    43    44    48    52    53    56  
   42    43    44    45    46    47    48    52    53    56    50  
   43    44    45    46    52  
   44    45    46    52  
   45    46    47    48    49    52    54    50    51  
   46    47    48    50  
   47    48    49    52    53    56    54    55    50    51  
   48    49    52    54    50    51  
   49    52    53    56    57    54    55    50    51  
   52    53    56    54    55    50  
   51    52    54  
    0  
   53    56    57    54    55  
   56    57    54  
   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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   46   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   51   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   52   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   55   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   56   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   57   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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   268.000  1.529
   39    52   268.000  1.529
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    44   317.000  1.522
   44    45   570.000  1.229
   44    46   317.000  1.522
   46    47   340.000  1.090
   46    48   268.000  1.529
   46    50   320.000  1.410
   48    49   340.000  1.090
   48    52   268.000  1.529
   48    54   320.000  1.410
   52    53   340.000  1.090
   52    56   320.000  1.410
   56    57   553.000  0.945
   54    55   553.000  0.945
   50    51   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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    58.35000  112.70000
   33    39    52    58.35000  112.70000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    37.50000  110.70000
   39    41    43    37.50000  110.70000
   39    41    44    63.00000  111.10000
   39    52    48    58.35000  112.70000
   39    52    53    37.50000  110.70000
   39    52    56    50.00000  109.50000
   41    39    40    37.50000  110.70000
   41    44    45    80.00000  120.40000
   41    44    46    70.00000  116.00000
   43    41    42    33.00000  107.80000
   44    41    42    35.00000  109.50000
   44    41    43    35.00000  109.50000
   44    46    47    35.00000  109.50000
   44    46    48    63.00000  111.10000
   44    46    50    90.00000  109.61100
   46    44    45    80.00000  120.40000
   46    48    49    37.50000  110.70000
   46    48    52    58.35000  112.70000
   46    48    54    50.00000  109.50000
   46    50    51    55.00000  108.50000
   48    46    47    37.50000  110.70000
   48    52    53    37.50000  110.70000
   48    52    56    50.00000  109.50000
   48    54    55    55.00000  108.50000
   52    39    40    37.50000  110.70000
   52    39    41    58.35000  112.70000
   52    48    49    37.50000  110.70000
   52    56    57    55.00000  108.50000
   56    52    53    35.00000  109.50000
   54    48    49    35.00000  109.50000
   54    48    52    50.00000  109.50000
   50    46    47    35.00000  109.50000
   50    46    48    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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    35   0.32350  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    39    40   0.15000  1.0 3.0
   29    33    39    41   0.44750  1.0 1.0
   29    33    39    41  -0.17800 -1.0 2.0
   29    33    39    41   0.20200  1.0 3.0
   29    33    39    52   0.44750  1.0 1.0
   29    33    39    52  -0.17800 -1.0 2.0
   29    33    39    52   0.20200  1.0 3.0
   33    39    41    42   0.15000  1.0 3.0
   33    39    41    43   0.15000  1.0 3.0
   33    39    41    44  -0.95700  1.0 1.0
   33    39    41    44  -0.18200 -1.0 2.0
   33    39    41    44   0.29450  1.0 3.0
   33    39    52    48   0.56750  1.0 1.0
   33    39    52    48  -0.07550 -1.0 2.0
   33    39    52    48   0.20000  1.0 3.0
   33    39    52    53   0.15000  1.0 3.0
   33    39    52    56   0.86500  1.0 1.0
   33    39    52    56  -0.17500 -1.0 2.0
   33    39    52    56   0.20800  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    52   0.15000  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41   0.15000  1.0 3.0
   35    33    39    52   0.15000  1.0 3.0
   39    41    44    45   0.30150 -1.0 2.0
   39    41    44    46   0.60050  1.0 1.0
   39    41    44    46   0.05600 -1.0 2.0
   39    41    44    46   0.26150  1.0 3.0
   39    52    56    57  -0.11600  1.0 1.0
   39    52    56    57  -0.09450 -1.0 2.0
   39    52    56    57   0.21250  1.0 3.0
   40    39    41    42   0.15000  1.0 3.0
   40    39    41    43   0.15000  1.0 3.0
   40    39    41    44  -0.11250  1.0 3.0
   40    39    52    48   0.15000  1.0 3.0
   40    39    52    53   0.15000  1.0 3.0
   40    39    52    56   0.23400  1.0 3.0
   41    39    52    48   0.56750  1.0 1.0
   41    39    52    48  -0.07550 -1.0 2.0
   41    39    52    48   0.20000  1.0 3.0
   41    39    52    53   0.15000  1.0 3.0
   41    39    52    56   0.86500  1.0 1.0
   41    39    52    56  -0.17500 -1.0 2.0
   41    39    52    56   0.20800  1.0 3.0
   41    44    46    47   0.00000  1.0 1.0
   41    44   -46    48   0.60050  1.0 1.0
   41    44   -46    48   0.05600 -1.0 2.0
   41    44   -46    48   0.26150  1.0 3.0
   41    44    46    50   0.55300  1.0 1.0
   41    44    46    50   1.25850 -1.0 2.0
   41    44    46    50  -0.23600  1.0 3.0
   42    41    44    45   0.00000  1.0 1.0
   42    41    44    46   0.00000  1.0 1.0
   43    41    44    45   0.00000  1.0 1.0
   43    41    44    46   0.00000  1.0 1.0
   44    46    48    49  -0.11250  1.0 3.0
   44    46    48    52  -0.95700  1.0 1.0
   44    46    48    52  -0.18200 -1.0 2.0
   44    46    48    52   0.29450  1.0 3.0
   44    46    48    54  -0.09450  1.0 1.0
   44    46    48    54  -1.12950 -1.0 2.0
   44    46    48    54   0.54000  1.0 3.0
   44    46    50    51   0.91850  1.0 1.0
   44    46    50    51   0.57950  1.0 3.0
   45    44    46    47   0.00000  1.0 1.0
   45    44    46    48   0.30150 -1.0 2.0
   45    44    46    50   0.30150 -1.0 2.0
   46    48   -52    39   0.56750  1.0 1.0
   46    48   -52    39  -0.07550 -1.0 2.0
   46    48   -52    39   0.20000  1.0 3.0
   46    48    52    53   0.15000  1.0 3.0
   46    48    52    56   0.86500  1.0 1.0
   46    48    52    56  -0.17500 -1.0 2.0
   46    48    52    56   0.20800  1.0 3.0
   46    48    54    55  -0.11600  1.0 1.0
   46    48    54    55  -0.09450 -1.0 2.0
   46    48    54    55   0.21250  1.0 3.0
   47    46    48    49   0.15000  1.0 3.0
   47    46    48    52   0.15000  1.0 3.0
   47    46    48    54   0.23400  1.0 3.0
   47    46    50    51   0.19450  1.0 3.0
   48    46    50    51  -0.11600  1.0 1.0
   48    46    50    51  -0.09450 -1.0 2.0
   48    46    50    51   0.21250  1.0 3.0
   48    52    56    57  -0.11600  1.0 1.0
   48    52    56    57  -0.09450 -1.0 2.0
   48    52    56    57   0.21250  1.0 3.0
   49    48    52    39   0.15000  1.0 3.0
   49    48    52    53   0.15000  1.0 3.0
   49    48    52    56   0.23400  1.0 3.0
   49    48    54    55   0.19450  1.0 3.0
   52    39    41    42   0.15000  1.0 3.0
   52    39    41    43   0.15000  1.0 3.0
   52    39   -41    44  -0.95700  1.0 1.0
   52    39   -41    44  -0.18200 -1.0 2.0
   52    39   -41    44   0.29450  1.0 3.0
   52    48    54    55  -0.11600  1.0 1.0
   52    48    54    55  -0.09450 -1.0 2.0
   52    48    54    55   0.21250  1.0 3.0
   53    52    56    57   0.19450  1.0 3.0
   54    48    52    39   0.86500  1.0 1.0
   54    48    52    39  -0.17500 -1.0 2.0
   54    48    52    39   0.20800  1.0 3.0
   54    48    52    53   0.23400  1.0 3.0
   54    48    52    56   3.75450  1.0 1.0
   50    46    48    49   0.23400  1.0 3.0
   50    46    48    52   0.86500  1.0 1.0
   50    46    48    52  -0.17500 -1.0 2.0
   50    46    48    52   0.20800  1.0 3.0
   50    46    48    54   3.75450  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
   37    30    36    38  10.50000 -1.0 2.0
   41    46    44    45  10.50000 -1.0 2.0
END
