* LIGAND DATABASE FILE (OPLS2005)
*
001      57    58    107    165     304
    1     0 S   NP   _N1_     1    31.07640    99.58539   -21.86176
    2     1 S   H    _HN1     2     1.02852    62.46163   -97.92877
    3     1 S   H    _H1_     3     1.02731    65.72240   134.91020
    4     1 S   H    _H2_     4     1.03478   163.35014  -155.57742
    5     1 S   CT   _CA1     5     1.50139    84.48028    18.88523
    6     5 S   HC   _HA1     6     1.09534   104.96386   118.65400
    7     5 S   CO3  _C1_     7     1.53754   113.23762    -2.04947
    8     7 S   O2Z  _O11     8     1.26439   115.06217   -30.29842
    9     7 S   O2Z  _O12     9     1.26235   115.16098   149.17531
   10     5 S   CT   _CB1    10     1.53006   107.38694  -122.82303
   11    10 S   HC   HB11    11     1.09568   109.35283   -39.87935
   12    10 S   HC   HB12    12     1.09834   110.42290    75.66585
   13    10 S   CT   _CG1    13     1.53301   112.99408  -162.52685
   14    13 S   HC   HG11    14     1.09540   110.83407   -95.62902
   15    13 S   HC   HG12    15     1.09637   111.68861    23.80176
   16    13 S   C    _CD1    16     1.51504   109.65734   143.94564
   17    16 S   O    _OE1    17     1.22754   122.23737    97.45633
   18    16 S   N    _N2_    18     1.38431   112.14644   -79.84685
   19    18 S   H    _HN2    19     1.01885   118.72465    -3.74554
   20    18 S   CT1  _CA2    20     1.45883   123.44960   172.66219
   21    20 S   HC   _HA2    21     1.09672   108.81345    29.40559
   22    20 S   C    _C2_    22     1.53249   108.67350   -87.33957
   23    22 S   O    _O2_    23     1.23112   121.10474   152.10039
   24    20 S   CT   _CB2    32     1.53231   111.67629   152.94797
   25    24 S   HC   HB21    33     1.09417   109.89260    58.54200
   26    24 S   HC   HB22    34     1.09553   110.10149   176.48008
   27    22 S   N    _N3_    24     1.38378   114.41760   -35.48302
   28    27 S   H    _HN3    25     1.01581   119.40342     2.54438
   29    24 S   S    _SG2    35     1.82813   111.30236   -63.88246
   30    27 S   CT   _CA3    26     1.45282   123.31296  -177.61050
   31    30 S   HC   HA31    27     1.09558   108.21577   -45.44904
   32    30 S   HC   HA32    28     1.09545   107.23736    70.94595
   33    29 S   CT   _C9_    36     1.85061   100.96442   148.93873
   34    30 S   CO3  _C3_    29     1.53047   114.36048  -167.65838
   35    34 S   O2Z  _O31    30     1.26432   116.34839     1.74260
   36    34 S   O2Z  _O32    31     1.26427   114.40593  -178.48561
   37    33 S   CT1  _C8_    37     1.55363   115.36760   -64.44288
   38    37 S   HC   _H5_    38     1.09823   109.46133    95.45972
   39    33 S   CT   _C10    54     1.53959   108.48461    62.17660
   40    39 S   HC   _H9_    55     1.09719   112.11597    52.20930
   41    39 S   HC   _H10    56     1.09579   111.48850   -68.40043
   42    39 S   HC   _H11    57     1.09548   112.30425   172.65265
   43    37 S   N4   _N4_    39     1.45822   104.88271  -149.83601
   44    37 S   CO3  _C11    51     1.54666   116.69460   -27.48140
   45    44 S   O2Z  _O35    52     1.26256   116.39603   -67.30391
   46    44 S   O2Z  _O34    53     1.26637   114.52768   112.47357
   47    43 S   C4   _C7_    40     1.36095   127.52519   -87.07052
   48    47 S   O    _O33    41     1.20971   132.59210   -38.99814
   49    43 S   C4T  _C6_    44     1.46089   118.54013    37.44052
   50    49 S   HC   _H4_    45     1.09387   112.98063   101.33714
   51    47 S   C4T  _C5_    42     1.54588    91.12858   135.28693
   52    51 S   HC   _H3_    43     1.09762   111.93041  -116.93004
   53    33 S   S    _S1_    46     1.87259   107.93506   176.85315
   54    51 S   CT   _C4_    47     1.51729   115.22943   115.18879
   55    54 S   HC   _H6_    48     1.09514   111.72843   -49.34818
   56    54 S   HC   _H7_    49     1.09465   110.47815  -169.63527
   57    54 S   HC   _H8_    50     1.09474   110.58308    70.99135
  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
  15   2   1   1  15   8   7   3   2   1  11   5   1   1  10   4
   8   4   6   5   1   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    53    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    43    49    53    44    39    40    41    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    43    47    51    49    50    53    44    45    46    39    40    41    42  
   35    36  
   36  
    0  
   38    43    47    48    51    49    50    53    44    45    46    39    40    41    42  
   43    47    49    53    44    45    46    39  
   40    41    42    43    44    49    53  
   41    42    53  
   42    53  
   53  
   47    48    51    52    49    50    53    54    44    45    46  
   45    46    47    49    53  
   46  
    0  
   48    51    52    49    50    53    54    55    56    57  
   51    52    49    54  
   50    53    54    55    56    57    51    52  
   53    54    51    52  
   52    53    54    55    56    57  
   53    54    55    56    57  
   54  
   55    56    57  
   56    57  
   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   0.335000   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  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.2500   0.1700  -0.445000   1.8100   1.6000   0.054801302  -1.445846770
   44   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   47   3.7500   0.1050   0.665000   1.9250   1.7000   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.506500   1.5250   1.4250   0.001000000  -1.480495490
   49   3.5000   0.0660   0.219000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   51   3.5000   0.0660  -0.154800   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.6000   0.3550  -0.324000   2.0300   1.8000   0.025682759  -1.666211680
   54   3.5000   0.0660  -0.121200   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
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    53   222.000  1.810
   33    39   268.000  1.529
   37    38   340.000  1.090
   37    43   337.000  1.449
   37    44   317.000  1.522
   43    47   440.000  1.369
   43    49   305.000  1.456
   47    48   930.000  1.212
   47    51   250.000  1.540
   51    52   340.000  1.090
   51    49   268.000  1.529
   51    54   260.000  1.519
   49    50   340.000  1.090
   49    53   200.000  1.824
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   340.000  1.090
   44    45   656.000  1.250
   44    46   656.000  1.250
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    42   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    53    75.00000  118.28000
   29    33    39    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    43    80.00000  109.70000
   33    37    44    63.00000  111.10000
   33    53    49    85.00000   99.86700
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    42    37.50000  110.70000
   37    43    47    50.00000  132.10000
   37    43    49    50.00000  132.70000
   37    44    45    70.00000  117.00000
   37    44    46    70.00000  117.00000
   43    37    38    35.00000  109.50000
   43    47    48    75.00000  131.60000
   43    47    51    95.00000   92.72400
   43    49    51   105.00000   87.49700
   43    49    50    50.00000  112.01000
   43    49    53    80.00000  108.62000
   47    51    52    40.00000  113.37500
   47    51    49   100.00000   86.36000
   47    51    54    63.00000  111.10000
   51    47    48    60.00000  136.58000
   51    49    50    37.50000  110.70000
   51    49    53    65.00000  119.05700
   51    54    55    45.00000  111.22300
   51    54    56    45.00000  111.22300
   51    54    57    45.00000  111.22300
   49    43    47   100.00000   93.00000
   49    51    52    37.50000  110.70000
   53    33    37    75.00000  108.68000
   53    49    50    45.00000  109.41400
   54    51    52    45.00000  112.72800
   54    51    49    65.00000  119.52000
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    33.00000  107.80000
   44    37    38    35.00000  109.50000
   44    37    43    63.00000  110.10000
   46    44    45    80.00000  126.00000
   39    33    37    58.35000  112.70000
   39    33    53    75.00000  111.63000
   41    39    40    33.00000  107.80000
   42    39    40    33.00000  107.80000
   42    39    41    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  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    53   0.08500  1.0 1.0
   24    29    33    53  -0.53150 -1.0 2.0
   24    29    33    53   0.48050  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    43   0.71400  1.0 1.0
   29    33    37    43   0.04300 -1.0 2.0
   29    33    37    43   0.01450  1.0 3.0
   29    33    37    44  -2.17200  1.0 1.0
   29    33    37    44  -0.85700 -1.0 2.0
   29    33    53    49   0.08500  1.0 1.0
   29    33    53    49  -0.53150 -1.0 2.0
   29    33    53    49   0.48050  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    42   0.15000  1.0 3.0
   33    37    43    47   0.00000  1.0 1.0
   33    37   -43    49   0.00000  1.0 1.0
   33    37    44    45   0.00000  1.0 1.0
   33    37    44    46   0.00000  1.0 1.0
   37    33   -53    49  -0.25000 -1.0 2.0
   37    33   -53    49  -0.01800  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    42   0.15000  1.0 3.0
   37    43    47    48   3.00000 -1.0 2.0
   37    43    47    51   3.00000 -1.0 2.0
   37    43   -49    51   0.00000  1.0 1.0
   37    43    49    50   0.00000  1.0 1.0
   37    43   -49    53   0.00000  1.0 1.0
   38    37    43    47   0.00000  1.0 1.0
   38    37    43    49   0.00000  1.0 1.0
   38    37    44    45   0.00000  1.0 1.0
   38    37    44    46   0.00000  1.0 1.0
   43    37    44    45   0.00000  1.0 1.0
   43    37    44    46   0.00000  1.0 1.0
   43    47    51    52   0.00000  1.0 1.0
   43    47   -51    49   3.00000 -1.0 2.0
   43    47    51    54   1.39750  1.0 1.0
   43    47    51    54  -0.07950 -1.0 2.0
   43    47    51    54  -0.18750  1.0 3.0
   43    49   -53    33   0.01700  1.0 1.0
   43    49   -53    33  -0.23550 -1.0 2.0
   43    49   -53    33   0.21350  1.0 3.0
   47    43   -49    51   0.00000  1.0 1.0
   47    43    49    50   0.00000  1.0 1.0
   47    43    49    53   0.00000  1.0 1.0
   47    51   -49    43   3.00000 -1.0 2.0
   47    51   -49    50   0.15000  1.0 3.0
   47    51   -49    53   0.00000  1.0 1.0
   47    51    54    55  -0.11250  1.0 3.0
   47    51    54    56  -0.11250  1.0 3.0
   47    51    54    57  -0.11250  1.0 3.0
   48    47    51    52   0.00000  1.0 1.0
   48    47    51    49  -0.11250  1.0 1.0
   48    47    51    49   0.11400 -1.0 2.0
   48    47    51    49  -0.28950  1.0 3.0
   48    47    51    54   0.30150 -1.0 2.0
   51    49    53    33   0.25150  1.0 1.0
   51    49    53    33  -1.17200 -1.0 2.0
   51    49    53    33   0.53050  1.0 3.0
   52    51   -49    43   0.15000  1.0 3.0
   52    51    49    50   0.15000  1.0 3.0
   52    51    49    53   0.00000  1.0 1.0
   52    51    54    55   0.15000  1.0 3.0
   52    51    54    56   0.15000  1.0 3.0
   52    51    54    57   0.15000  1.0 3.0
   49    43   -47    48   3.00000 -1.0 2.0
   49    43   -47    51   3.00000 -1.0 2.0
   49    51    54    55   0.00000  1.0 1.0
   49    51    54    56   0.00000  1.0 1.0
   49    51    54    57   0.00000  1.0 1.0
   50    49    53    33   0.00000  1.0 1.0
   53    33    37    38   0.15000  1.0 3.0
   53    33   -37    43   0.71400  1.0 1.0
   53    33   -37    43   0.04300 -1.0 2.0
   53    33   -37    43   0.01450  1.0 3.0
   53    33    37    44  -2.17200  1.0 1.0
   53    33    37    44  -0.85700 -1.0 2.0
   53    33    39    40   0.15000  1.0 3.0
   53    33    39    41   0.15000  1.0 3.0
   53    33    39    42   0.15000  1.0 3.0
   54    51   -49    43   0.43900  1.0 1.0
   54    51   -49    43   0.49100 -1.0 2.0
   54    51   -49    43   0.28400  1.0 3.0
   54    51    49    50   0.15000  1.0 3.0
   54    51    49    53   0.44750  1.0 1.0
   54    51    49    53  -0.17800 -1.0 2.0
   54    51    49    53   0.20200  1.0 3.0
   44    37    43    47   0.00000  1.0 1.0
   44    37    43    49   0.00000  1.0 1.0
   39    33    37    38   0.15000  1.0 3.0
   39    33    37    43   0.42250  1.0 1.0
   39    33    37    43  -0.48100 -1.0 2.0
   39    33    37    43   0.35650  1.0 3.0
   39    33    37    44  -0.84850  1.0 1.0
   39    33    37    44  -0.22800 -1.0 2.0
   39    33    37    44   0.29250  1.0 3.0
   39    33    53    49  -0.25000 -1.0 2.0
   39    33    53    49  -0.01800  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
   49    47    43    37   1.00000 -1.0 2.0
   43    51    47    48  10.50000 -1.0 2.0
   45    37    44    46  10.50000 -1.0 2.0
END
