* LIGAND DATABASE FILE (OPLS2005)
*
001      57    57    104    160     310
    1     0 S   NP   _N1_     1    29.02365    93.46103   -19.97168
    2     1 S   H    _HN1     2     1.02817    72.64836   -97.31633
    3     1 S   H    _H1_     3     1.02951   103.30790     7.79092
    4     1 S   H    _H2_     4     1.02860    38.71255   108.82769
    5     1 S   CT   _CA1     5     1.50028   141.18189   158.85691
    6     5 S   HC   _HA1     6     1.09557   105.43118    29.01996
    7     5 S   CO3  _C1_     7     1.53955   112.07642   -91.64837
    8     7 S   O2Z  _O11     8     1.26472   115.43291   -55.01736
    9     7 S   O2Z  _O12     9     1.26195   115.15680   124.60251
   10     5 S   CT   _CB1    10     1.53134   107.49248   147.15305
   11    10 S   HC   HB11    11     1.09814   110.11808   -47.64617
   12    10 S   HC   HB12    12     1.09823   109.89884    68.81844
   13    10 S   CT   _CG1    13     1.53157   112.50992  -168.58359
   14    13 S   HC   HG11    14     1.09543   110.56553   -44.73850
   15    13 S   HC   HG12    15     1.09578   110.26759    74.29940
   16    13 S   C    _CD1    16     1.51731   111.62979  -165.07844
   17    16 S   O    _OE1    17     1.22743   123.02431   -17.99763
   18    16 S   N    _N2_    18     1.38573   111.88748   161.54146
   19    18 S   H    _HN2    19     1.01564   119.34154     6.27785
   20    18 S   CT1  _CA2    20     1.46260   123.05035  -170.84258
   21    20 S   HC   _HA2    21     1.09717   109.42853    -9.56511
   22    20 S   C    _C2_    22     1.53261   108.88330  -125.81442
   23    22 S   O    _O2_    23     1.23014   122.17512  -146.06128
   24    20 S   CT   _CB2    32     1.53596   110.78762   111.81794
   25    24 S   HC   HB21    33     1.09399   109.35278    61.31599
   26    24 S   HC   HB22    34     1.09517   110.62642   179.42802
   27    22 S   N    _N3_    24     1.38488   113.39968    41.32126
   28    27 S   H    _HN3    25     1.01523   118.92838    -0.40542
   29    24 S   S    _SG2    35     1.83134   111.47071   -60.80867
   30    27 S   CT   _CA3    26     1.45452   123.38953   175.13784
   31    30 S   HC   HA31    27     1.09527   109.16751    25.55566
   32    30 S   HC   HA32    28     1.09493   107.13074   142.54972
   33    29 S   CT   _C6_    36     1.83524   100.40517   149.82276
   34    33 S   HC   _H4_    37     1.09608   107.99523    46.79847
   35    30 S   CO3  _C3_    29     1.52936   113.19931   -97.87549
   36    35 S   O2Z  _O31    30     1.26396   115.44205   -43.42571
   37    35 S   O2Z  _O32    31     1.26363   114.96000   137.53174
   38    33 S   CO4  _C7_    38     1.52352   108.63324   -70.59685
   39    38 S   O    _O33    39     1.23208   121.21780   103.90971
   40    38 S   CT   _C8_    40     1.52517   117.19412   -73.40637
   41    40 S   HC   _H5_    41     1.09490   108.77143    71.51731
   42    40 S   CT   _C9_    42     1.52453   109.75323   -50.98882
   43    42 S   HC   _H6_    43     1.09678   110.65111   -71.45005
   44    40 S   OH   _O34    56     1.41986   109.67193  -170.36853
   45    44 S   HO   _H12    57     0.97329   107.47117   -60.58617
   46    42 S   CT   _C4_    44     1.52642   112.63048    52.68848
   47    46 S   HC   _H7_    45     1.09788   109.22542  -177.54003
   48    46 S   HC   _H8_    46     1.09748   110.55080    66.00792
   49    42 S   NP   _N4_    52     1.49022   108.73403   173.42282
   50    49 S   H    _H9_    53     1.03403   112.45930   -60.74562
   51    49 S   H    _H10    54     1.02775   112.10488   177.95943
   52    49 S   H    _H11    55     1.02972   110.70534    57.74672
   53    33 S   CT   _C5_    47     1.54121   113.14124   168.11970
   54    53 S   HC   _H3_    48     1.10147   107.01041  -174.45313
   55    53 S   CO3  _C10    49     1.54386   111.64784   -60.90162
   56    55 S   O2Z  _O36    50     1.26217   116.09939   128.96520
   57    55 S   O2Z  _O35    51     1.26458   114.72962   -52.22463
  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
  15   7   2   1   1  12   5  13   6  13   9   3   1  11   5   4
   4   2   1   1   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    53    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    46    53    54    55  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    46    47    48    53    54    55    56    57    44  
   38    39    40    46    53    54    55  
   36    37  
   37  
    0  
   39    40    41    42    43    46    53    54    55    49    44    45  
   40    41    42    53    44  
   41    42    43    46    47    48    53    49    50    51    52    44    45  
   42    43    46    49    44    45  
   43    46    47    48    53    54    55    49    50    51    52    44    45  
   46    47    48    53    49    50    51    52    44  
   45    46    49  
    0  
   47    48    53    54    55    56    57    49    50    51    52  
   48    53    54    55    49  
   53    54    55    49  
   50    51    52    53  
   51    52  
   52  
    0  
   54    55    56    57  
   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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.4200   0.0150   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   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   39   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   40   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.4200   0.0150   0.060000   1.6450   1.4500   0.008598240   0.268726247
   42   3.5000   0.0660   0.250000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   44   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   45   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   46   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   49   3.2500   0.1700  -0.300000   2.1950   1.9500   0.003973653   1.685851020
   50   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   51   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   52   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   53   3.5000   0.0660  -0.160000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   55   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   56   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.800000   1.7000   1.5000   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    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  1.522
   33    53   268.000  1.529
   38    39   570.000  1.229
   38    40   317.000  1.522
   40    41   340.000  1.090
   40    42   268.000  1.529
   40    44   320.000  1.410
   42    43   340.000  1.090
   42    46   268.000  1.529
   42    49   367.000  1.471
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    53   268.000  1.529
   53    54   340.000  1.090
   53    55   317.000  1.522
   55    56   656.000  1.250
   55    57   656.000  1.250
   49    50   434.000  1.010
   49    51   434.000  1.010
   49    52   434.000  1.010
   44    45   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    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  110.18000
   29    33    53    75.00000  111.63000
   33    38    39    80.00000  120.40000
   33    38    40    70.00000  116.00000
   33    53    46    58.35000  112.70000
   33    53    54    37.50000  110.70000
   33    53    55    70.00000  109.69300
   38    33    34    35.00000  109.50000
   38    40    41    35.00000  109.50000
   38    40    42    63.00000  111.10000
   38    40    44    90.00000  109.61100
   40    38    39    80.00000  120.40000
   40    42    43    37.50000  110.70000
   40    42    46    58.35000  112.70000
   40    42    49    80.00000  111.20000
   40    44    45    55.00000  108.50000
   42    40    41    37.50000  110.70000
   42    46    47    37.50000  110.70000
   42    46    48    37.50000  110.70000
   42    46    53    58.35000  112.70000
   42    49    50    35.00000  109.50000
   42    49    51    35.00000  109.50000
   42    49    52    35.00000  109.50000
   46    42    43    37.50000  110.70000
   46    53    54    37.50000  110.70000
   46    53    55    70.00000  109.69300
   48    46    47    33.00000  107.80000
   53    33    34    37.50000  110.70000
   53    33    38    63.00000  111.10000
   53    46    47    37.50000  110.70000
   53    46    48    37.50000  110.70000
   53    55    56    70.00000  117.00000
   53    55    57    70.00000  117.00000
   55    53    54    35.00000  109.50000
   57    55    56    80.00000  126.00000
   49    42    43    35.00000  109.50000
   49    42    46    80.00000  111.20000
   51    49    50    35.00000  109.50000
   52    49    50    35.00000  109.50000
   52    49    51    35.00000  109.50000
   44    40    41    35.00000  109.50000
   44    40    42    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    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   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    53   0.01700  1.0 1.0
   24    29    33    53  -0.23550 -1.0 2.0
   24    29    33    53   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   0.30150 -1.0 2.0
   29    33    38    40   0.65300  1.0 1.0
   29    33    38    40  -0.03850 -1.0 2.0
   29    33    38    40   0.33900  1.0 3.0
   29    33    53    46   0.44750  1.0 1.0
   29    33    53    46  -0.17800 -1.0 2.0
   29    33    53    46   0.20200  1.0 3.0
   29    33    53    54   0.15000  1.0 3.0
   29    33    53    55   0.56750  1.0 1.0
   29    33    53    55  -0.07550 -1.0 2.0
   29    33    53    55   0.20000  1.0 3.0
   33    38    40    41   0.00000  1.0 1.0
   33    38    40    42   0.60050  1.0 1.0
   33    38    40    42   0.05600 -1.0 2.0
   33    38    40    42   0.26150  1.0 3.0
   33    38    40    44   0.55300  1.0 1.0
   33    38    40    44   1.25850 -1.0 2.0
   33    38    40    44  -0.23600  1.0 3.0
   33    53    55    56   0.41150 -1.0 2.0
   33    53    55    57   0.41150 -1.0 2.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    53    46   0.15000  1.0 3.0
   34    33    53    54   0.15000  1.0 3.0
   34    33    53    55  -0.11250  1.0 3.0
   38    33    53    46  -0.95700  1.0 1.0
   38    33    53    46  -0.18200 -1.0 2.0
   38    33    53    46   0.29450  1.0 3.0
   38    33    53    54  -0.11250  1.0 3.0
   38    33    53    55  -0.30950  1.0 1.0
   38    33    53    55   1.11150 -1.0 2.0
   38    33    53    55   0.40350  1.0 3.0
   38    40    42    43  -0.11250  1.0 3.0
   38    40   -42    46  -0.95700  1.0 1.0
   38    40   -42    46  -0.18200 -1.0 2.0
   38    40   -42    46   0.29450  1.0 3.0
   38    40    42    49  -1.46550  1.0 1.0
   38    40    42    49  -0.30600 -1.0 2.0
   38    40    42    49  -0.05950  1.0 3.0
   38    40    44    45   0.91850  1.0 1.0
   38    40    44    45   0.57950  1.0 3.0
   39    38    40    41   0.00000  1.0 1.0
   39    38    40    42   0.30150 -1.0 2.0
   39    38    40    44   0.30150 -1.0 2.0
   40    42    46    47   0.15000  1.0 3.0
   40    42    46    48   0.15000  1.0 3.0
   40    42    46    53   0.56750  1.0 1.0
   40    42    46    53  -0.07550 -1.0 2.0
   40    42    46    53   0.20000  1.0 3.0
   40    42    49    50   0.17350  1.0 3.0
   40    42    49    51   0.17350  1.0 3.0
   40    42    49    52   0.17350  1.0 3.0
   41    40    42    43   0.15000  1.0 3.0
   41    40    42    46   0.15000  1.0 3.0
   41    40    42    49   0.19200  1.0 3.0
   41    40    44    45   0.19450  1.0 3.0
   42    40    44    45  -0.11600  1.0 1.0
   42    40    44    45  -0.09450 -1.0 2.0
   42    40    44    45   0.21250  1.0 3.0
   42    46   -53    33   0.56750  1.0 1.0
   42    46   -53    33  -0.07550 -1.0 2.0
   42    46   -53    33   0.20000  1.0 3.0
   42    46    53    54   0.15000  1.0 3.0
   42    46    53    55  -1.63150  1.0 1.0
   42    46    53    55  -0.43550 -1.0 2.0
   42    46    53    55   0.24500  1.0 3.0
   43    42    46    47   0.15000  1.0 3.0
   43    42    46    48   0.15000  1.0 3.0
   43    42    46    53   0.15000  1.0 3.0
   43    42    49    50   0.13050  1.0 3.0
   43    42    49    51   0.13050  1.0 3.0
   43    42    49    52   0.13050  1.0 3.0
   46    42    49    50   0.17350  1.0 3.0
   46    42    49    51   0.17350  1.0 3.0
   46    42    49    52   0.17350  1.0 3.0
   46    53    55    56   0.41150 -1.0 2.0
   46    53    55    57   0.41150 -1.0 2.0
   47    46    53    33   0.15000  1.0 3.0
   47    46    53    54   0.15000  1.0 3.0
   47    46    53    55  -0.11250  1.0 3.0
   48    46    53    33   0.15000  1.0 3.0
   48    46    53    54   0.15000  1.0 3.0
   48    46    53    55  -0.11250  1.0 3.0
   53    33    38    39   0.30150 -1.0 2.0
   53    33   -38    40   0.60050  1.0 1.0
   53    33   -38    40   0.05600 -1.0 2.0
   53    33   -38    40   0.26150  1.0 3.0
   54    53    55    56   0.00000  1.0 1.0
   54    53    55    57   0.00000  1.0 1.0
   49    42    46    47   0.19200  1.0 3.0
   49    42    46    48   0.19200  1.0 3.0
   49    42    46    53   1.36600  1.0 1.0
   49    42    46    53  -0.11450 -1.0 2.0
   49    42    46    53   0.24250  1.0 3.0
   44    40    42    43   0.23400  1.0 3.0
   44    40    42    46   0.86500  1.0 1.0
   44    40    42    46  -0.17500 -1.0 2.0
   44    40    42    46   0.20800  1.0 3.0
   44    40    42    49   1.69300  1.0 1.0
   44    40    42    49  -0.48450 -1.0 2.0
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    40    38    39  10.50000 -1.0 2.0
   56    53    55    57  10.50000 -1.0 2.0
END
