* LIGAND DATABASE FILE (OPLS2005)
*
001      60    59    104    144     298
    1     0 S   NP   _N1_     1    28.02832    96.18167   -22.98732
    2     1 S   H    _HN1     2     1.02835    31.13285   144.90961
    3     1 S   H    _H1_     3     1.02777   101.93704  -110.18032
    4     1 S   H    _H2_     4     1.02957    80.57970    -3.27333
    5     1 S   CT   _CA1     5     1.50124   137.33236   106.67553
    6     5 S   HC   _HA1     6     1.09575   105.21921    79.19154
    7     5 S   CO3  _C1_     7     1.53790   112.35508   -40.99711
    8     7 S   O2Z  _O11     8     1.26363   114.99975   -44.30117
    9     7 S   O2Z  _O12     9     1.26237   114.93035   134.79928
   10     5 S   CT   _CB1    10     1.53097   107.42128  -162.91303
   11    10 S   HC   HB11    11     1.09826   109.33358   -50.65322
   12    10 S   HC   HB12    12     1.09816   110.43121    65.90472
   13    10 S   CT   _CG1    13     1.53009   112.65717  -171.73110
   14    13 S   HC   HG11    14     1.09598   110.47306   -64.18120
   15    13 S   HC   HG12    15     1.09656   109.93334    55.00759
   16    13 S   C    _CD1    16     1.51840   112.33671   175.37090
   17    16 S   O    _OE1    17     1.22748   123.29738    -0.52190
   18    16 S   N    _N2_    18     1.38533   111.66750   179.52522
   19    18 S   H    _HN2    19     1.01554   119.05270     4.39766
   20    18 S   CT1  _CA2    20     1.45887   122.97237   178.27887
   21    20 S   HC   _HA2    21     1.09722   108.94025    23.99269
   22    20 S   C    _C2_    22     1.52907   106.84130   -93.13739
   23    22 S   O    _O2_    23     1.23000   122.98542   -28.53556
   24    20 S   CT   _CB2    32     1.53270   112.11701   147.18180
   25    24 S   HC   HB21    33     1.09482   109.60587    54.63767
   26    24 S   HC   HB22    34     1.09475   109.89826   173.41429
   27    22 S   N    _N3_    24     1.38495   112.66231   154.10831
   28    27 S   H    _HN3    25     1.01661   120.36193    -1.57942
   29    24 S   S    _SG2    35     1.83173   110.58762   -66.22267
   30    27 S   CT   _CA3    26     1.45354   122.38974   178.71854
   31    30 S   HC   HA31    27     1.09570   107.62622   -59.36827
   32    30 S   HC   HA32    28     1.09568   107.75655    56.91506
   33    29 S   CT   _C8_    36     1.87308   101.74230   176.38572
   34    33 S   OM   _O34    37     1.31579   108.16231    63.76064
   35    30 S   CO3  _C3_    29     1.52873   114.44442   178.78856
   36    35 S   O2Z  _O31    30     1.26320   116.11299    -1.63051
   37    35 S   O2Z  _O32    31     1.26453   114.38712   178.40554
   38    33 S   NT   _N5_    38     1.46774   113.43975   -57.08556
   39    38 S   H    _H10    39     1.01686   108.33085    68.88102
   40    33 S   S    _S1_    44     1.87396   105.61132   179.41953
   41    38 S   CT   _C9_    40     1.45509   117.25315   -56.36939
   42    41 S   HC   _H11    41     1.09362   112.56515   -58.63399
   43    41 S   HC   _H12    42     1.09512   108.66564  -176.42040
   44    41 S   HC   _H13    43     1.09369   112.59711    65.30435
   45    40 S   CT   _C7_    45     1.83776   101.37518   178.52276
   46    45 S   HC   _H8_    46     1.09473   108.41260    70.11671
   47    45 S   HC   _H9_    47     1.09407   108.87715   -47.05783
   48    45 S   CT1  _C6_    48     1.53685   112.37015  -167.67542
   49    48 S   HC   _H3_    49     1.09858   107.48449   176.35025
   50    48 S   CO3  _C10    50     1.54404   111.59122   -67.83688
   51    50 S   O2Z  _O36    51     1.26488   115.76573   122.07336
   52    50 S   O2Z  _O35    52     1.26478   115.07490   -59.28837
   53    48 S   N    _N4_    53     1.46539   111.88198    60.22622
   54    53 S   H    _H7_    54     1.01608   116.56426  -102.94143
   55    53 S   C    _C5_    55     1.38132   123.61140    75.79680
   56    55 S   O    _O33    56     1.22788   125.62044     0.77632
   57    55 S   CT   _C4_    57     1.50446   112.39984  -178.14006
   58    57 S   HC   _H4_    58     1.09344   109.36628    74.67895
   59    57 S   HC   _H5_    59     1.09349   109.64858  -165.50947
   60    57 S   HC   _H6_    60     1.09379   110.46159   -45.85989
  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   2   1   1   7   5   8   3   2   1   1  10   5   4   9
   6   5   2   1   7   3   5   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    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    41    40    45  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    41    42    43    44    40    45    46    47    48  
   38    39    41    40    45  
   36    37  
   37  
    0  
   39    41    42    43    44    40    45  
   41    42    43    44    40  
   45    46    47    48    49    50    53    41  
   42    43    44  
   43    44  
   44  
    0  
   46    47    48    49    50    51    52    53    54    55  
   47    48    49    50    53  
   48    49    50    53  
   49    50    51    52    53    54    55    56    57  
   50    51    52    53    54    55  
   51    52    53    54    55  
   52    53  
   53  
   54    55    56    57    58    59    60  
   55    56    57  
   56    57    58    59    60  
   57    58    59    60  
   58    59    60  
   59    60  
   60  
    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  -0.175000   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   4.2000   0.3000   0.117500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   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   3.3000   0.1700  -0.702500   1.8650   1.6500   0.051222218  -2.220205820
   39   0.5000   0.0300   0.380000   0.9960   0.8600   0.030040813  -0.651083722
   40   3.6000   0.3550  -0.175000   2.0300   1.8000   0.025682759  -1.666211680
   41   3.5000   0.0660   0.020000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660   0.040000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   50   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   51   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   53   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   54   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   55   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   56   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   57   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   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    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   570.000  1.307
   33    38   382.000  1.448
   33    40   222.000  1.810
   38    39   434.000  1.010
   38    41   382.000  1.448
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    44   340.000  1.090
   40    45   222.000  1.810
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   268.000  1.529
   48    49   340.000  1.090
   48    50   317.000  1.522
   48    53   337.000  1.449
   50    51   656.000  1.250
   50    52   656.000  1.250
   53    54   434.000  1.010
   53    55   490.000  1.335
   55    56   570.000  1.229
   55    57   317.000  1.522
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   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    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    85.00000  114.68000
   29    33    38    85.00000  109.00000
   29    33    40    75.00000  118.28000
   33    38    39    35.00000  109.50000
   33    38    41    51.80000  107.20000
   33    40    45    62.00000   98.90000
   38    33    34   110.00000  105.70000
   38    41    42    35.00000  109.50000
   38    41    43    35.00000  109.50000
   38    41    44    35.00000  109.50000
   41    38    39    35.00000  109.50000
   43    41    42    33.00000  107.80000
   44    41    42    33.00000  107.80000
   44    41    43    33.00000  107.80000
   40    33    34    85.00000  114.68000
   40    33    38    85.00000  109.00000
   40    45    46    35.00000  109.50000
   40    45    47    35.00000  109.50000
   40    45    48    75.00000  108.68000
   45    48    49    37.50000  110.70000
   45    48    50    63.00000  111.10000
   45    48    53    80.00000  109.70000
   47    45    46    33.00000  107.80000
   48    45    46    37.50000  110.70000
   48    45    47    37.50000  110.70000
   48    50    51    70.00000  117.00000
   48    50    52    70.00000  117.00000
   48    53    54    38.00000  118.40000
   48    53    55    50.00000  121.90000
   50    48    49    35.00000  109.50000
   52    50    51    80.00000  126.00000
   53    48    49    35.00000  109.50000
   53    48    50    63.00000  110.10000
   53    55    56    80.00000  122.90000
   53    55    57    70.00000  116.60000
   55    53    54    35.00000  119.80000
   55    57    58    35.00000  109.50000
   55    57    59    35.00000  109.50000
   55    57    60    35.00000  109.50000
   57    55    56    80.00000  120.40000
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    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    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   0.13850  1.0 1.0
   24    29    33    34  -1.34450 -1.0 2.0
   24    29    33    34   0.57400  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    40   0.08500  1.0 1.0
   24    29    33    40  -0.53150 -1.0 2.0
   24    29    33    40   0.48050  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  -0.05900  1.0 1.0
   29    33    38    39   0.08350 -1.0 2.0
   29    33    38    39   0.12500  1.0 3.0
   29    33    38    41   0.23200  1.0 1.0
   29    33    38    41   0.02100 -1.0 2.0
   29    33    38    41   0.24950  1.0 3.0
   29    33    40    45   0.08500  1.0 1.0
   29    33    40    45  -0.53150 -1.0 2.0
   29    33    40    45   0.48050  1.0 3.0
   33    38    41    42   0.28000  1.0 3.0
   33    38    41    43   0.28000  1.0 3.0
   33    38    41    44   0.28000  1.0 3.0
   33    40    45    46   0.32350  1.0 3.0
   33    40    45    47   0.32350  1.0 3.0
   33    40    45    48   0.01700  1.0 1.0
   33    40    45    48  -0.23550 -1.0 2.0
   33    40    45    48   0.21350  1.0 3.0
   34    33    38    39  -0.05900  1.0 1.0
   34    33    38    39   0.08350 -1.0 2.0
   34    33    38    39   0.12500  1.0 3.0
   34    33    38    41   0.23200  1.0 1.0
   34    33    38    41   0.02100 -1.0 2.0
   34    33    38    41   0.24950  1.0 3.0
   34    33    40    45   0.13850  1.0 1.0
   34    33    40    45  -1.34450 -1.0 2.0
   34    33    40    45   0.57400  1.0 3.0
   38    33    40    45   0.01700  1.0 1.0
   38    33    40    45  -0.23550 -1.0 2.0
   38    33    40    45   0.21350  1.0 3.0
   39    38    41    42   0.20000  1.0 3.0
   39    38    41    43   0.20000  1.0 3.0
   39    38    41    44   0.20000  1.0 3.0
   40    33    38    39  -0.05900  1.0 1.0
   40    33    38    39   0.08350 -1.0 2.0
   40    33    38    39   0.12500  1.0 3.0
   40    33    38    41   0.23200  1.0 1.0
   40    33    38    41   0.02100 -1.0 2.0
   40    33    38    41   0.24950  1.0 3.0
   40    45    48    49   0.15000  1.0 3.0
   40    45    48    50  -2.17200  1.0 1.0
   40    45    48    50  -0.85700 -1.0 2.0
   40    45    48    53   0.71400  1.0 1.0
   40    45    48    53   0.04300 -1.0 2.0
   40    45    48    53   0.01450  1.0 3.0
   45    48    50    51   0.00000  1.0 1.0
   45    48    50    52   0.00000  1.0 1.0
   45    48    53    54   0.00000  1.0 1.0
   45    48    53    55   0.25950  1.0 1.0
   45    48    53    55   0.43850 -1.0 2.0
   45    48    53    55   2.61650  1.0 3.0
   46    45    48    49   0.15000  1.0 3.0
   46    45    48    50  -0.03800  1.0 3.0
   46    45    48    53   0.23200  1.0 3.0
   47    45    48    49   0.15000  1.0 3.0
   47    45    48    50  -0.03800  1.0 3.0
   47    45    48    53   0.23200  1.0 3.0
   48    53    55    56   3.04450 -1.0 2.0
   48    53    55    57   1.15000  1.0 1.0
   48    53    55    57   3.04450 -1.0 2.0
   49    48    50    51   0.00000  1.0 1.0
   49    48    50    52   0.00000  1.0 1.0
   49    48    53    54   0.00000  1.0 1.0
   49    48    53    55   0.00000  1.0 1.0
   50    48    53    54   0.00000  1.0 1.0
   50    48    53    55  -0.29800  1.0 1.0
   50    48    53    55   0.13950 -1.0 2.0
   50    48    53    55  -2.45650  1.0 3.0
   53    48    50    51   0.00000  1.0 1.0
   53    48    50    52   0.00000  1.0 1.0
   53    55    57    58   0.00000  1.0 1.0
   53    55    57    59   0.00000  1.0 1.0
   53    55    57    60   0.00000  1.0 1.0
   54    53    55    56   2.45000 -1.0 2.0
   54    53    55    57   2.45000 -1.0 2.0
   56    55    57    58   0.00000  1.0 1.0
   56    55    57    59   0.00000  1.0 1.0
   56    55    57    60   0.00000  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
   51    48    50    52  10.50000 -1.0 2.0
   54    55    53    48   1.00000 -1.0 2.0
   53    57    55    56  10.50000 -1.0 2.0
END
