* LIGAND DATABASE FILE (OPLS2005)
*
001      59    61    116    194     346
    1     0 S   NP   _N1_     1    28.82165    95.10132   -24.06006
    2     1 S   H    _HN1     2     1.02949    78.80933    15.35190
    3     1 S   H    _H1_     3     1.02828    29.39846   179.28866
    4     1 S   H    _H2_     4     1.02785   110.39694   -90.26261
    5     1 S   CT   _CA1     5     1.50119   130.06542   122.67516
    6     5 S   HC   _HA1     6     1.09573   105.18592    85.22889
    7     5 S   CO3  _C1_     7     1.53781   112.46508   -34.98877
    8     7 S   O2Z  _O11     8     1.26372   115.00161   -42.31499
    9     7 S   O2Z  _O12     9     1.26239   114.94580   136.78570
   10     5 S   CT   _CB1    10     1.53076   107.41571  -156.79664
   11    10 S   HC   HB11    11     1.09834   109.35003   -49.70232
   12    10 S   HC   HB12    12     1.09812   110.45601    66.89983
   13    10 S   CT   _CG1    13     1.52995   112.61970  -170.67886
   14    13 S   HC   HG11    14     1.09581   110.64161   -66.14479
   15    13 S   HC   HG12    15     1.09671   109.77377    53.09015
   16    13 S   C    _CD1    16     1.51805   112.19771   173.53371
   17    16 S   O    _OE1    17     1.22733   123.27557     7.76946
   18    16 S   N    _N2_    18     1.38656   111.69339  -172.33609
   19    18 S   H    _HN2    19     1.01581   118.92695     1.55897
   20    18 S   CT1  _CA2    20     1.46187   123.36997   177.16248
   21    20 S   HC   _HA2    21     1.09737   109.37095     2.59344
   22    20 S   C    _C2_    22     1.53555   108.59210  -112.87260
   23    22 S   O    _O2_    23     1.23063   122.27012  -147.71492
   24    20 S   CT   _CB2    32     1.53317   111.65411   124.62960
   25    24 S   HC   HB21    33     1.09593   110.13037    55.99847
   26    24 S   HC   HB22    34     1.09372   110.03672   174.95042
   27    22 S   N    _N3_    24     1.38324   113.70394    39.70788
   28    27 S   H    _HN3    25     1.01585   119.58324    -3.30535
   29    24 S   S    _SG2    35     1.82629   111.55278   -64.67038
   30    27 S   CT   _CA3    26     1.45282   123.21882   177.14097
   31    30 S   HC   HA31    27     1.09549   107.50901   -64.59045
   32    30 S   HC   HA32    28     1.09556   107.98785    51.84967
   33    29 S   CT   _C7_    36     1.84493    99.53835  -179.68286
   34    33 S   HC   _H6_    37     1.09487   108.38650   -28.39006
   35    30 S   CO3  _C3_    29     1.52960   114.07635   173.84215
   36    35 S   O2Z  _O31    30     1.26376   116.07017    -0.82662
   37    35 S   O2Z  _O32    31     1.26427   114.40957   179.23511
   38    33 S   CT   _C8_    38     1.54745   112.67945    95.16819
   39    38 S   HC   _H7_    39     1.09432   108.58076  -163.42111
   40    38 S   CT   _C4_    40     1.53591   104.18452    77.72927
   41    40 S   HC   _H3_    41     1.09866   109.16395   -91.09195
   42    38 S   OH   _O33    58     1.41383   114.63525   -43.93171
   43    42 S   HO   _H8_    59     0.97228   107.61536   -63.25153
   44    40 S   CT   _C5_    42     1.57093   105.45946    26.67551
   45    44 S   HC   _H4_    43     1.09871   108.47457  -116.67067
   46    33 S   CT   _C6_    44     1.54597   113.52268  -151.76053
   47    46 S   Cl   Cl1_    45     1.77308   115.77431    47.99285
   48    46 S   HC   _H5_    46     1.09363   107.60707   165.06595
   49    44 S   CT   _C9_    47     1.56363   102.63604   126.45888
   50    49 S   Cl   Cl7_    48     1.75075   114.00548   161.55091
   51    49 S   CM   _C10    49     1.51639   108.63714   -66.66775
   52    51 S   Cl   Cl6_    50     1.69389   124.52195  -110.03638
   53    51 S   CM   _C11    51     1.33882   107.54404    69.47640
   54    53 S   Cl   Cl5_    52     1.69391   127.88113  -179.58883
   55    40 S   CT   _C12    53     1.56345   119.62547   141.34626
   56    55 S   Cl   Cl4_    54     1.75097   113.90878    81.56065
   57    49 S   CT   _C13    55     1.56848   101.67956    36.70429
   58    57 S   Cl   Cl2_    56     1.79449   114.80325    60.94008
   59    57 S   Cl   Cl3_    57     1.80507   114.54437  -175.81961
  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  10   5   4   3
  14   8   2   1   1  15   7  18   9   4   1  14   8   7   2   1
  10   7   8   4   6   3   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    46    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    44    46    47    48    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    44    45    46    47    48    49    55    42    43  
   38    39    40    44    46    47    48    42  
   36    37  
   37  
    0  
   39    40    41    44    45    46    47    48    49    53    55    56    57    42    43  
   40    41    44    46    55    42    43  
   41    44    45    46    47    48    49    50    51    53    54    55    56    57    58    59    42    43  
   44    45    46    49    53    55    56    57    42  
   43    44    46    55  
    0  
   45    46    47    48    49    50    51    52    53    55    56    57    58    59  
   46    47    48    49    50    51    55    57  
   47    48    49    50    51    55    57  
   48    49  
   49  
   50    51    52    53    54    55    56    57    58    59  
   51    52    53    55    57    58    59  
   52    53    54    55    56    57    58    59  
   53    54    55    57  
   54    55    56    57    58    59  
   55    56    57  
   56    57    58    59  
   57    58    59  
   58    59  
   59  
    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   2.5000   0.0300   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   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   43   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   44   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660   0.097000   1.9750   1.7500   0.005000000  -0.741685710
   47   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   48   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   50   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   51   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   52   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   53   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   54   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   55   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   56   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   57   3.5000   0.0660   0.271600   1.9750   1.7500   0.005000000  -0.741685710
   58   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   59   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
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    46   268.000  1.529
   38    39   340.000  1.090
   38    40   268.000  1.529
   38    42   320.000  1.410
   40    41   340.000  1.090
   40    44   268.000  1.529
   40    55   268.000  1.529
   44    45   340.000  1.090
   44    46   268.000  1.529
   44    49   268.000  1.529
   46    47   245.000  1.781
   46    48   340.000  1.090
   49    50   245.000  1.781
   49    51   317.000  1.510
   49    57   268.000  1.529
   51    52   300.000  1.725
   51    53   549.000  1.340
   53    54   300.000  1.725
   53    55   317.000  1.510
   55    56   245.000  1.781
   55    57   268.000  1.529
   57    58   245.000  1.781
   57    59   245.000  1.781
   42    43   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  111.63000
   29    33    46    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    58.35000  112.70000
   33    38    42    50.00000  109.50000
   33    46    44    58.35000  112.70000
   33    46    47    69.00000  109.80000
   33    46    48    37.50000  110.70000
   38    33    34    37.50000  110.70000
   38    40    41    37.50000  110.70000
   38    40    44    58.35000  112.70000
   38    40    55    58.35000  112.70000
   38    42    43    55.00000  108.50000
   40    38    39    37.50000  110.70000
   40    44    45    37.50000  110.70000
   40    44    46    58.35000  112.70000
   40    44    49    58.35000  112.70000
   40    55    53    70.00000  112.02700
   40    55    56    69.00000  109.80000
   40    55    57    58.35000  112.70000
   44    40    41    37.50000  110.70000
   44    46    47    69.00000  109.80000
   44    46    48    37.50000  110.70000
   44    49    50    69.00000  109.80000
   44    49    51    70.00000  112.02700
   44    49    57    58.35000  112.70000
   46    33    34    37.50000  110.70000
   46    33    38    58.35000  112.70000
   46    44    45    37.50000  110.70000
   48    46    47    51.00000  107.60000
   49    44    45    37.50000  110.70000
   49    44    46    58.35000  112.70000
   49    51    52    75.00000  111.02000
   49    51    53    70.00000  124.00000
   49    57    55    58.35000  112.70000
   49    57    58    69.00000  109.80000
   49    57    59    69.00000  109.80000
   51    49    50    75.00000  111.90500
   51    53    54    75.00000  121.50000
   51    53    55    70.00000  124.00000
   53    51    52    75.00000  121.50000
   53    55    56    75.00000  111.90500
   53    55    57    70.00000  112.02700
   55    40    41    37.50000  110.70000
   55    40    44    58.35000  112.70000
   55    53    54    75.00000  111.02000
   55    57    58    69.00000  109.80000
   55    57    59    69.00000  109.80000
   57    49    50    69.00000  109.80000
   57    49    51    70.00000  112.02700
   57    55    56    69.00000  109.80000
   59    57    58    80.00000  110.42200
   42    38    39    35.00000  109.50000
   42    38    40    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    46   0.01700  1.0 1.0
   24    29    33    46  -0.23550 -1.0 2.0
   24    29    33    46   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   0.15000  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    46    44   0.44750  1.0 1.0
   29    33    46    44  -0.17800 -1.0 2.0
   29    33    46    44   0.20200  1.0 3.0
   29    33    46    47   0.56750  1.0 1.0
   29    33    46    47  -0.07550 -1.0 2.0
   29    33    46    47   0.20000  1.0 3.0
   29    33    46    48   0.15000  1.0 3.0
   33    38    40    41   0.15000  1.0 3.0
   33    38   -40    44   0.56750  1.0 1.0
   33    38   -40    44  -0.07550 -1.0 2.0
   33    38   -40    44   0.20000  1.0 3.0
   33    38    40    55   0.56750  1.0 1.0
   33    38    40    55  -0.07550 -1.0 2.0
   33    38    40    55   0.20000  1.0 3.0
   33    38    42    43  -0.11600  1.0 1.0
   33    38    42    43  -0.09450 -1.0 2.0
   33    38    42    43   0.21250  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   0.23400  1.0 3.0
   34    33    46    44   0.15000  1.0 3.0
   34    33    46    47   0.27000  1.0 3.0
   34    33    46    48   0.15000  1.0 3.0
   38    33   -46    44   0.56750  1.0 1.0
   38    33   -46    44  -0.07550 -1.0 2.0
   38    33   -46    44   0.20000  1.0 3.0
   38    33    46    47   0.35600  1.0 1.0
   38    33    46    47  -0.14650 -1.0 2.0
   38    33    46    47   0.33350  1.0 3.0
   38    33    46    48   0.15000  1.0 3.0
   38    40    44    45   0.15000  1.0 3.0
   38    40   -44    46   0.56750  1.0 1.0
   38    40   -44    46  -0.07550 -1.0 2.0
   38    40   -44    46   0.20000  1.0 3.0
   38    40    44    49   0.56750  1.0 1.0
   38    40    44    49  -0.07550 -1.0 2.0
   38    40    44    49   0.20000  1.0 3.0
   38    40    55    53   0.34400  1.0 1.0
   38    40    55    53   0.09450 -1.0 2.0
   38    40    55    53   0.11100  1.0 3.0
   38    40    55    56   0.35600  1.0 1.0
   38    40    55    56  -0.14650 -1.0 2.0
   38    40    55    56   0.33350  1.0 3.0
   38    40    55    57   0.56750  1.0 1.0
   38    40    55    57  -0.07550 -1.0 2.0
   38    40    55    57   0.20000  1.0 3.0
   39    38    40    41   0.15000  1.0 3.0
   39    38    40    44   0.15000  1.0 3.0
   39    38    40    55   0.15000  1.0 3.0
   39    38    42    43   0.19450  1.0 3.0
   40    38    42    43  -0.11600  1.0 1.0
   40    38    42    43  -0.09450 -1.0 2.0
   40    38    42    43   0.21250  1.0 3.0
   40    44   -46    33   0.56750  1.0 1.0
   40    44   -46    33  -0.07550 -1.0 2.0
   40    44   -46    33   0.20000  1.0 3.0
   40    44    46    47   0.35600  1.0 1.0
   40    44    46    47  -0.14650 -1.0 2.0
   40    44    46    47   0.33350  1.0 3.0
   40    44    46    48   0.15000  1.0 3.0
   40    44    49    50   0.35600  1.0 1.0
   40    44    49    50  -0.14650 -1.0 2.0
   40    44    49    50   0.33350  1.0 3.0
   40    44    49    51   0.34400  1.0 1.0
   40    44    49    51   0.09450 -1.0 2.0
   40    44    49    51   0.11100  1.0 3.0
   40    44   -49    57   0.56750  1.0 1.0
   40    44   -49    57  -0.07550 -1.0 2.0
   40    44   -49    57   0.20000  1.0 3.0
   40    55   -57    49   0.56750  1.0 1.0
   40    55   -57    49  -0.07550 -1.0 2.0
   40    55   -57    49   0.20000  1.0 3.0
   40    55    57    58   0.35600  1.0 1.0
   40    55    57    58  -0.14650 -1.0 2.0
   40    55    57    58   0.33350  1.0 3.0
   40    55    57    59   0.35600  1.0 1.0
   40    55    57    59  -0.14650 -1.0 2.0
   40    55    57    59   0.33350  1.0 3.0
   41    40    44    45   0.15000  1.0 3.0
   41    40    44    46   0.15000  1.0 3.0
   41    40    44    49   0.15000  1.0 3.0
   41    40    55    53   0.15000  1.0 3.0
   41    40    55    56   0.27000  1.0 3.0
   41    40    55    57   0.15000  1.0 3.0
   44    40    55    53   0.34400  1.0 1.0
   44    40    55    53   0.09450 -1.0 2.0
   44    40    55    53   0.11100  1.0 3.0
   44    40    55    56   0.35600  1.0 1.0
   44    40    55    56  -0.14650 -1.0 2.0
   44    40    55    56   0.33350  1.0 3.0
   44    40   -55    57   0.56750  1.0 1.0
   44    40   -55    57  -0.07550 -1.0 2.0
   44    40   -55    57   0.20000  1.0 3.0
   44    49    51    52   0.09700  1.0 1.0
   44    49    51    52   0.15600 -1.0 2.0
   44    49    51    52  -0.50800  1.0 3.0
   44    49   -51    53   0.09850  1.0 1.0
   44    49   -51    53   0.15250 -1.0 2.0
   44    49   -51    53  -0.50650  1.0 3.0
   44    49   -57    55   0.56750  1.0 1.0
   44    49   -57    55  -0.07550 -1.0 2.0
   44    49   -57    55   0.20000  1.0 3.0
   44    49    57    58   0.35600  1.0 1.0
   44    49    57    58  -0.14650 -1.0 2.0
   44    49    57    58   0.33350  1.0 3.0
   44    49    57    59   0.35600  1.0 1.0
   44    49    57    59  -0.14650 -1.0 2.0
   44    49    57    59   0.33350  1.0 3.0
   45    44    46    33   0.15000  1.0 3.0
   45    44    46    47   0.27000  1.0 3.0
   45    44    46    48   0.15000  1.0 3.0
   45    44    49    50   0.27000  1.0 3.0
   45    44    49    51   0.15000  1.0 3.0
   45    44    49    57   0.15000  1.0 3.0
   46    33    38    39   0.15000  1.0 3.0
   46    33   -38    40   0.56750  1.0 1.0
   46    33   -38    40  -0.07550 -1.0 2.0
   46    33   -38    40   0.20000  1.0 3.0
   46    33    38    42   0.86500  1.0 1.0
   46    33    38    42  -0.17500 -1.0 2.0
   46    33    38    42   0.20800  1.0 3.0
   46    44    49    50   0.35600  1.0 1.0
   46    44    49    50  -0.14650 -1.0 2.0
   46    44    49    50   0.33350  1.0 3.0
   46    44    49    51   0.34400  1.0 1.0
   46    44    49    51   0.09450 -1.0 2.0
   46    44    49    51   0.11100  1.0 3.0
   46    44    49    57   0.56750  1.0 1.0
   46    44    49    57  -0.07550 -1.0 2.0
   46    44    49    57   0.20000  1.0 3.0
   49    44    46    33   0.56750  1.0 1.0
   49    44    46    33  -0.07550 -1.0 2.0
   49    44    46    33   0.20000  1.0 3.0
   49    44    46    47   0.35600  1.0 1.0
   49    44    46    47  -0.14650 -1.0 2.0
   49    44    46    47   0.33350  1.0 3.0
   49    44    46    48   0.15000  1.0 3.0
   49    51    53    54   7.00000 -1.0 2.0
   49    51   -53    55   7.00000 -1.0 2.0
   50    49    51    52   0.09700  1.0 1.0
   50    49    51    52   0.15600 -1.0 2.0
   50    49    51    52  -0.50800  1.0 3.0
   50    49    51    53   0.09700  1.0 1.0
   50    49    51    53   0.15600 -1.0 2.0
   50    49    51    53  -0.50800  1.0 3.0
   50    49    57    55   0.35600  1.0 1.0
   50    49    57    55  -0.14650 -1.0 2.0
   50    49    57    55   0.33350  1.0 3.0
   50    49    57    58   0.22500  1.0 1.0
   50    49    57    59   0.22500  1.0 1.0
   51    49   -57    55   0.34400  1.0 1.0
   51    49   -57    55   0.09450 -1.0 2.0
   51    49   -57    55   0.11100  1.0 3.0
   51    49    57    58   0.56750  1.0 1.0
   51    49    57    58  -0.07550 -1.0 2.0
   51    49    57    58   0.20000  1.0 3.0
   51    49    57    59   0.56750  1.0 1.0
   51    49    57    59  -0.07550 -1.0 2.0
   51    49    57    59   0.20000  1.0 3.0
   51    53   -55    40   0.09850  1.0 1.0
   51    53   -55    40   0.15250 -1.0 2.0
   51    53   -55    40  -0.50650  1.0 3.0
   51    53    55    56   0.09700  1.0 1.0
   51    53    55    56   0.15600 -1.0 2.0
   51    53    55    56  -0.50800  1.0 3.0
   51    53   -55    57   0.09850  1.0 1.0
   51    53   -55    57   0.15250 -1.0 2.0
   51    53   -55    57  -0.50650  1.0 3.0
   52    51    53    54   7.00000 -1.0 2.0
   52    51    53    55   7.00000 -1.0 2.0
   53    55   -57    49   0.34400  1.0 1.0
   53    55   -57    49   0.09450 -1.0 2.0
   53    55   -57    49   0.11100  1.0 3.0
   53    55    57    58   0.56750  1.0 1.0
   53    55    57    58  -0.07550 -1.0 2.0
   53    55    57    58   0.20000  1.0 3.0
   53    55    57    59   0.56750  1.0 1.0
   53    55    57    59  -0.07550 -1.0 2.0
   53    55    57    59   0.20000  1.0 3.0
   54    53    55    40   0.09700  1.0 1.0
   54    53    55    40   0.15600 -1.0 2.0
   54    53    55    40  -0.50800  1.0 3.0
   54    53    55    56   0.09700  1.0 1.0
   54    53    55    56   0.15600 -1.0 2.0
   54    53    55    56  -0.50800  1.0 3.0
   54    53    55    57   0.09700  1.0 1.0
   54    53    55    57   0.15600 -1.0 2.0
   54    53    55    57  -0.50800  1.0 3.0
   55    40    44    45   0.15000  1.0 3.0
   55    40    44    46   0.56750  1.0 1.0
   55    40    44    46  -0.07550 -1.0 2.0
   55    40    44    46   0.20000  1.0 3.0
   55    40   -44    49   0.56750  1.0 1.0
   55    40   -44    49  -0.07550 -1.0 2.0
   55    40   -44    49   0.20000  1.0 3.0
   56    55    57    49   0.35600  1.0 1.0
   56    55    57    49  -0.14650 -1.0 2.0
   56    55    57    49   0.33350  1.0 3.0
   56    55    57    58   0.22500  1.0 1.0
   56    55    57    59   0.22500  1.0 1.0
   57    49    51    52   0.09700  1.0 1.0
   57    49    51    52   0.15600 -1.0 2.0
   57    49    51    52  -0.50800  1.0 3.0
   57    49   -51    53   0.09850  1.0 1.0
   57    49   -51    53   0.15250 -1.0 2.0
   57    49   -51    53  -0.50650  1.0 3.0
   42    38    40    41   0.23400  1.0 3.0
   42    38    40    44   0.86500  1.0 1.0
   42    38    40    44  -0.17500 -1.0 2.0
   42    38    40    44   0.20800  1.0 3.0
   42    38    40    55   0.86500  1.0 1.0
   42    38    40    55  -0.17500 -1.0 2.0
   42    38    40    55   0.20800  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
   36    30    35    37  10.50000 -1.0 2.0
   49    52    51    53   1.10000 -1.0 2.0
   55    54    53    51   1.10000 -1.0 2.0
END
