* LIGAND DATABASE FILE (OPLS2005)
*
001      58    58    104    158     311
    1     0 S   NP   _N1_     1    28.79309    96.01441   -23.76644
    2     1 S   H    _HN1     2     1.02948    73.61125     9.79651
    3     1 S   H    _H1_     3     1.02827    35.46000   169.95835
    4     1 S   H    _H2_     4     1.02788   108.25689   -94.61987
    5     1 S   CT   _CA1     5     1.50124   134.90808   112.49572
    6     5 S   HC   _HA1     6     1.09573   105.17257    90.78685
    7     5 S   CO3  _C1_     7     1.53780   112.46594   -29.42368
    8     7 S   O2Z  _O11     8     1.26376   114.99742   -42.19674
    9     7 S   O2Z  _O12     9     1.26236   114.94569   136.84324
   10     5 S   CT   _CB1    10     1.53066   107.40939  -151.23347
   11    10 S   HC   HB11    11     1.09836   109.35366   -49.43814
   12    10 S   HC   HB12    12     1.09811   110.46403    67.17179
   13    10 S   CT   _CG1    13     1.52996   112.61332  -170.38951
   14    13 S   HC   HG11    14     1.09577   110.67968   -66.56909
   15    13 S   HC   HG12    15     1.09671   109.74223    52.66816
   16    13 S   C    _CD1    16     1.51804   112.12838   173.13259
   17    16 S   O    _OE1    17     1.22741   123.25322     9.58201
   18    16 S   N    _N2_    18     1.38633   111.72645  -170.51314
   19    18 S   H    _HN2    19     1.01589   118.97223     1.41347
   20    18 S   CT1  _CA2    20     1.46223   123.43095   177.16828
   21    20 S   HC   _HA2    21     1.09734   109.34252     5.25296
   22    20 S   C    _C2_    22     1.53606   108.80122  -110.28943
   23    22 S   O    _O2_    23     1.23074   122.24125  -148.87314
   24    20 S   CT   _CB2    32     1.53273   111.44352   127.26639
   25    24 S   HC   HB21    33     1.09550   109.82414    55.96724
   26    24 S   HC   HB22    34     1.09511   110.42397   175.05220
   27    22 S   N    _N3_    24     1.38320   113.80989    38.65884
   28    27 S   H    _HN3    25     1.01563   119.59905    -3.32543
   29    24 S   S    _SG2    35     1.82681   111.49947   -65.13951
   30    27 S   CT   _CA3    26     1.45280   123.24240   177.14919
   31    30 S   HC   HA31    27     1.09548   107.52568   -64.38532
   32    30 S   HC   HA32    28     1.09556   107.97269    52.05693
   33    29 S   CT   _C9_    36     1.83900    99.08303   178.03886
   34    33 S   HC   _H7_    37     1.09654   104.55550    60.53890
   35    30 S   CO3  _C3_    29     1.52966   114.07000   174.05855
   36    35 S   O2Z  _O31    30     1.26380   116.08401    -0.12033
   37    35 S   O2Z  _O32    31     1.26429   114.41161   179.92338
   38    33 S   CT   _C8_    38     1.54891   115.55139   177.78804
   39    38 S   HC   _H6_    39     1.09921   106.38349  -165.98889
   40    38 S   CT   _C7_    40     1.53783   112.37125    78.16948
   41    40 S   HC   _H5_    41     1.09660   110.89055   172.13264
   42    38 S   NTH2 _N4_    56     1.46498   113.32350   -48.45119
   43    42 S   H    _H10    57     1.01940   109.74158   -55.25425
   44    42 S   H    _H11    58     1.01939   109.82916  -171.98651
   45    40 S   CT   _C6_    42     1.53356   109.45071    51.03204
   46    45 S   HC   _H4_    43     1.09753   108.45064    66.11055
   47    40 S   OH   _O34    54     1.42766   111.01370   -69.60981
   48    47 S   HO   _H12    55     0.97366   107.01430   -44.56381
   49    45 S   CT   _C5_    44     1.53327   110.73894   -53.64978
   50    49 S   HC   _H3_    45     1.09700   111.03684   -63.71711
   51    45 S   OH   _O35    52     1.42383   110.50833  -176.02980
   52    51 S   HO   _H13    53     0.97225   107.82929   -49.26781
   53    33 S   OS   _O33    46     1.43549   112.96531   -53.81630
   54    49 S   CT   _C4_    47     1.53107   111.54182   176.32624
   55    54 S   HC   _H8_    48     1.09394   111.59196    53.51230
   56    54 S   HC   _H9_    49     1.09501   110.98793   -68.87829
   57    54 S   OH   _O36    50     1.42570   109.11814   172.48942
   58    57 S   HO   _H14    51     0.97233   106.97262   179.38261
  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   8   5   4   3
  14   6   2   1   1  13   8  14   7   5   1   1  12   7   3   1
   9   6   3   1   4   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    49    53    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    45    49    50    53    54    47    42    43    44  
   38    39    40    49    53    42  
   36    37  
   37  
    0  
   39    40    41    45    46    49    53    51    47    48    42    43    44  
   40    41    45    53    47    42    43    44  
   41    45    46    49    50    53    54    51    52    47    48    42    43    44  
   45    46    49    51    47    48    42  
   43    44    45    47    53  
   44  
    0  
   46    49    50    53    54    55    56    57    51    52    47    48  
   49    50    53    54    51    52    47  
   48    49    51  
    0  
   50    53    54    55    56    57    58    51    52  
   53    54    55    56    57    51  
   52    53    54  
    0  
   54    55    56    57  
   55    56    57    58  
   56    57    58  
   57    58  
   58  
    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  -0.316400   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   0.318900   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.030000   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   3.5000   0.0660   0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.3000   0.1700  -0.900000   1.8650   1.6500   0.051222218  -2.220205820
   43   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   44   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   45   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   48   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   49   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   51   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   52   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   53   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   54   3.5000   0.0660   0.145000   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   58   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    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   268.000  1.529
   33    53   320.000  1.410
   38    39   340.000  1.090
   38    40   268.000  1.529
   38    42   300.000  1.468
   40    41   340.000  1.090
   40    45   268.000  1.529
   40    47   320.000  1.410
   45    46   340.000  1.090
   45    49   268.000  1.529
   45    51   320.000  1.410
   49    50   340.000  1.090
   49    53   320.000  1.410
   49    54   268.000  1.529
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   320.000  1.410
   57    58   553.000  0.945
   51    52   553.000  0.945
   47    48   553.000  0.945
   42    43   495.000  1.019
   42    44   495.000  1.019
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  111.63000
   29    33    53    85.00000  114.68000
   33    38    39    37.50000  110.70000
   33    38    40    58.35000  112.70000
   33    38    42    80.00000  112.76400
   33    53    49    60.00000  109.50000
   38    33    34    37.50000  110.70000
   38    40    41    37.50000  110.70000
   38    40    45    58.35000  112.70000
   38    40    47    50.00000  109.50000
   38    42    43    50.00000  110.30900
   38    42    44    50.00000  110.30900
   40    38    39    37.50000  110.70000
   40    45    46    37.50000  110.70000
   40    45    49    58.35000  112.70000
   40    45    51    50.00000  109.50000
   40    47    48    55.00000  108.50000
   45    40    41    37.50000  110.70000
   45    49    50    37.50000  110.70000
   45    49    53    50.00000  109.50000
   45    49    54    58.35000  112.70000
   45    51    52    55.00000  108.50000
   49    45    46    37.50000  110.70000
   49    54    55    37.50000  110.70000
   49    54    56    37.50000  110.70000
   49    54    57    50.00000  109.50000
   53    33    34    35.00000  109.50000
   53    33    38    50.00000  109.50000
   53    49    50    35.00000  109.50000
   54    49    50    37.50000  110.70000
   54    49    53    50.00000  109.50000
   54    57    58    55.00000  108.50000
   56    54    55    33.00000  107.80000
   57    54    55    35.00000  109.50000
   57    54    56    35.00000  109.50000
   51    45    46    35.00000  109.50000
   51    45    49    50.00000  109.50000
   47    40    41    35.00000  109.50000
   47    40    45    50.00000  109.50000
   42    38    39    50.00000  110.79000
   42    38    40    80.00000  112.76400
   44    42    43    40.00000  106.77200
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   0.13850  1.0 1.0
   24    29    33    53  -1.34450 -1.0 2.0
   24    29    33    53   0.57400  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.44750  1.0 1.0
   29    33    38    40  -0.17800 -1.0 2.0
   29    33    38    40   0.20200  1.0 3.0
   29    33    38    42   0.56750  1.0 1.0
   29    33    38    42  -0.07550 -1.0 2.0
   29    33    38    42   0.20000  1.0 3.0
   29    33    53    49   0.14700  1.0 1.0
   29    33    53    49  -1.16150 -1.0 2.0
   29    33    53    49   0.48700  1.0 3.0
   33    38    40    41   0.15000  1.0 3.0
   33    38    40    45   0.56750  1.0 1.0
   33    38    40    45  -0.07550 -1.0 2.0
   33    38    40    45   0.20000  1.0 3.0
   33    38    40    47   0.86500  1.0 1.0
   33    38    40    47  -0.17500 -1.0 2.0
   33    38    40    47   0.20800  1.0 3.0
   33    38    42    43   0.21650  1.0 1.0
   33    38    42    43   0.26250 -1.0 2.0
   33    38    42    43   0.12450  1.0 3.0
   33    38    42    44   0.21650  1.0 1.0
   33    38    42    44   0.26250 -1.0 2.0
   33    38    42    44   0.12450  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    42   0.15000  1.0 3.0
   34    33    53    49   0.37050  1.0 3.0
   38    33    53    49   0.06250  1.0 1.0
   38    33    53    49  -0.01100 -1.0 2.0
   38    33    53    49   0.28050  1.0 3.0
   38    40    45    46   0.15000  1.0 3.0
   38    40   -45    49   0.56750  1.0 1.0
   38    40   -45    49  -0.07550 -1.0 2.0
   38    40   -45    49   0.20000  1.0 3.0
   38    40    45    51   0.86500  1.0 1.0
   38    40    45    51  -0.17500 -1.0 2.0
   38    40    45    51   0.20800  1.0 3.0
   38    40    47    48  -0.11600  1.0 1.0
   38    40    47    48  -0.09450 -1.0 2.0
   38    40    47    48   0.21250  1.0 3.0
   39    38    40    41   0.15000  1.0 3.0
   39    38    40    45   0.15000  1.0 3.0
   39    38    40    47   0.23400  1.0 3.0
   39    38    42    43   0.20000  1.0 3.0
   39    38    42    44   0.20000  1.0 3.0
   40    38    42    43   0.21650  1.0 1.0
   40    38    42    43   0.26250 -1.0 2.0
   40    38    42    43   0.12450  1.0 3.0
   40    38    42    44   0.21650  1.0 1.0
   40    38    42    44   0.26250 -1.0 2.0
   40    38    42    44   0.12450  1.0 3.0
   40    45    49    50   0.15000  1.0 3.0
   40    45    49    53   0.62750  1.0 1.0
   40    45    49    53  -0.30950 -1.0 2.0
   40    45    49    53   0.27300  1.0 3.0
   40    45    49    54   0.56750  1.0 1.0
   40    45    49    54  -0.07550 -1.0 2.0
   40    45    49    54   0.20000  1.0 3.0
   40    45    51    52  -0.11600  1.0 1.0
   40    45    51    52  -0.09450 -1.0 2.0
   40    45    51    52   0.21250  1.0 3.0
   41    40    45    46   0.15000  1.0 3.0
   41    40    45    49   0.15000  1.0 3.0
   41    40    45    51   0.23400  1.0 3.0
   41    40    47    48   0.19450  1.0 3.0
   45    40    47    48  -0.11600  1.0 1.0
   45    40    47    48  -0.09450 -1.0 2.0
   45    40    47    48   0.21250  1.0 3.0
   45    49   -53    33   0.06250  1.0 1.0
   45    49   -53    33  -0.01100 -1.0 2.0
   45    49   -53    33   0.28050  1.0 3.0
   45    49    54    55   0.15000  1.0 3.0
   45    49    54    56   0.15000  1.0 3.0
   45    49    54    57   0.86500  1.0 1.0
   45    49    54    57  -0.17500 -1.0 2.0
   45    49    54    57   0.20800  1.0 3.0
   46    45    49    50   0.15000  1.0 3.0
   46    45    49    53   0.23400  1.0 3.0
   46    45    49    54   0.15000  1.0 3.0
   46    45    51    52   0.19450  1.0 3.0
   49    45    51    52  -0.11600  1.0 1.0
   49    45    51    52  -0.09450 -1.0 2.0
   49    45    51    52   0.21250  1.0 3.0
   49    54    57    58  -0.11600  1.0 1.0
   49    54    57    58  -0.09450 -1.0 2.0
   49    54    57    58   0.21250  1.0 3.0
   50    49    53    33   0.37050  1.0 3.0
   50    49    54    55   0.15000  1.0 3.0
   50    49    54    56   0.15000  1.0 3.0
   50    49    54    57   0.23400  1.0 3.0
   53    33    38    39   0.23400  1.0 3.0
   53    33   -38    40   0.62750  1.0 1.0
   53    33   -38    40  -0.30950 -1.0 2.0
   53    33   -38    40   0.27300  1.0 3.0
   53    33    38    42   3.18800  1.0 1.0
   53    33    38    42  -1.12350 -1.0 2.0
   53    49    54    55   0.23400  1.0 3.0
   53    49    54    56   0.23400  1.0 3.0
   53    49    54    57   3.69350  1.0 1.0
   53    49    54    57  -1.82950 -1.0 2.0
   54    49    53    33   0.06250  1.0 1.0
   54    49    53    33  -0.01100 -1.0 2.0
   54    49    53    33   0.28050  1.0 3.0
   55    54    57    58   0.19450  1.0 3.0
   56    54    57    58   0.19450  1.0 3.0
   51    45    49    50   0.23400  1.0 3.0
   51    45    49    53   3.69350  1.0 1.0
   51    45    49    53  -1.82950 -1.0 2.0
   51    45    49    54   0.86500  1.0 1.0
   51    45    49    54  -0.17500 -1.0 2.0
   51    45    49    54   0.20800  1.0 3.0
   47    40    45    46   0.23400  1.0 3.0
   47    40    45    49   0.86500  1.0 1.0
   47    40    45    49  -0.17500 -1.0 2.0
   47    40    45    49   0.20800  1.0 3.0
   47    40    45    51   3.75450  1.0 1.0
   42    38    40    41   0.15000  1.0 3.0
   42    38    40    45   1.85550  1.0 1.0
   42    38    40    45  -0.84100 -1.0 2.0
   42    38    40    47   5.28650  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
   36    30    35    37  10.50000 -1.0 2.0
END
