* LIGAND DATABASE FILE (OPLS2005)
*
001      65    66    120    183     344
    1     0 S   NP   _N1_     1    28.74282    94.95473   -20.85597
    2     1 S   H    _HN1     2     1.02776    87.54290   -88.65868
    3     1 S   H    _H1_     3     1.02962    88.62161    19.74289
    4     1 S   H    _H2_     4     1.02832    34.17102   143.66033
    5     1 S   CT   _CA1     5     1.50164   144.93188   144.60750
    6     5 S   HC   _HA1     6     1.09568   105.21820    58.71593
    7     5 S   CO3  _C1_     7     1.53765   112.30041   -61.48706
    8     7 S   O2Z  _O11     8     1.26412   115.02058   -43.18278
    9     7 S   O2Z  _O12     9     1.26232   115.00260   135.96472
   10     5 S   CT   _CB1    10     1.53082   107.36616   176.66446
   11    10 S   HC   HB11    11     1.09825   109.34567   -49.34466
   12    10 S   HC   HB12    12     1.09826   110.38444    67.19414
   13    10 S   CT   _CG1    13     1.53033   112.79752  -170.42402
   14    13 S   HC   HG11    14     1.09569   110.43927   -63.09372
   15    13 S   HC   HG12    15     1.09638   110.06198    56.15619
   16    13 S   C    _CD1    16     1.51854   112.13765   176.37161
   17    16 S   O    _OE1    17     1.22737   123.19437    -5.02699
   18    16 S   N    _N2_    18     1.38623   111.76299   175.32639
   19    18 S   H    _HN2    19     1.01575   119.04418     1.61580
   20    18 S   CT1  _CA2    20     1.46337   123.33098  -177.58913
   21    20 S   HC   _HA2    21     1.09731   109.43322    -7.19609
   22    20 S   C    _C2_    22     1.53389   108.54604  -123.04623
   23    22 S   O    _O2_    23     1.23027   122.18078  -145.84143
   24    20 S   CT   _CB2    32     1.53634   111.25634   114.69212
   25    24 S   HC   HB21    33     1.09245   108.84480    58.41674
   26    24 S   HC   HB22    34     1.09457   110.20708   176.97547
   27    22 S   N    _N3_    24     1.38491   113.45201    41.48414
   28    27 S   H    _HN3    25     1.01518   118.90446    -0.58350
   29    24 S   S    _SG2    35     1.82727   110.87515   -63.30558
   30    27 S   CT   _CA3    26     1.45444   123.47381   175.24849
   31    30 S   HC   HA31    27     1.09522   109.27302    23.85687
   32    30 S   HC   HA32    28     1.09498   107.11773   140.85458
   33    29 S   CT   _C7_    36     1.86996   102.84292   164.47154
   34    30 S   CO3  _C3_    29     1.52915   113.06326   -99.65080
   35    34 S   O2Z  _O31    30     1.26405   115.37194   -45.60965
   36    34 S   O2Z  _O32    31     1.26350   115.00626   135.31072
   37    33 S   CT   _C8_    37     1.56123   112.42745   -57.49149
   38    37 S   HC   _H11    38     1.09419   111.20155    67.27601
   39    37 S   HC   _H12    39     1.09722   109.89773  -176.64065
   40    33 S   CT   _C6_    56     1.55110   108.16843    61.88282
   41    40 S   HC   _H9_    57     1.09531   111.85623    51.90414
   42    40 S   HC   _H10    58     1.09686   110.56976   -68.68712
   43    37 S   S    _S1_    40     1.82427   115.82235   -55.67180
   44    40 S   OS   _O34    59     1.44108   109.97321   172.44799
   45    43 S   C4T  _C9_    41     1.83168    97.58105   -56.44502
   46    45 S   HC   _H3_    42     1.09512   113.74983   -83.29583
   47    44 S   CO4  _C5_    60     1.36223   115.78384  -179.61845
   48    47 S   O    _O33    61     1.22324   126.31573    -1.18449
   49    45 S   C4T  _C10    43     1.55661   117.19278   139.91567
   50    49 S   HC   _H4_    44     1.09498   114.73832   144.15085
   51    45 S   N4   _N4_    47     1.46424   110.38844    43.34890
   52    47 S   CT   _C4_    62     1.49828   109.52640   179.00751
   53    52 S   HC   _H6_    63     1.09295   109.82562   -60.32913
   54    52 S   HC   _H7_    64     1.09379   109.36631  -179.33559
   55    52 S   HC   _H8_    65     1.09289   109.82540    61.56729
   56    49 S   C4   _C11    45     1.54551    85.27966  -102.46701
   57    56 S   O    _O35    46     1.20943   136.15417   170.43519
   58    33 S   CT1  _C12    48     1.56550   109.50650  -176.56995
   59    58 S   HC   _H5_    49     1.10163   105.90186   177.73739
   60    49 S   NT   _N5_    53     1.46026   113.25168    10.74437
   61    60 S   H    _H13    54     1.02101   114.15905  -166.27775
   62    60 S   H    _H14    55     1.01911   114.12951    71.86126
   63    58 S   CO3  _C13    50     1.55044   121.83316   -66.63205
   64    63 S   O2Z  _O37    51     1.26044   116.87885    12.11099
   65    63 S   O2Z  _O36    52     1.26722   114.32972  -166.78127
  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  13   5   4   3
  17   2   1   1  14   5   4  11   4   3   8   7  12   6   5   4
   8   6   8   3   2   1   1   7   2   4   3   2   1   1   2   1
   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    58    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    43    51    58    59    63    40    41    42    44  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    43    45    56    51    58    59    63    64    65    40    41    42    44    47  
   35    36  
   36  
    0  
   38    39    43    45    46    49    51    58    59    63    40    41    42    44  
   39    43    45    58    40  
   43    45    58    40  
   41    42    44    47    48    52    43    51    58    59    63  
   42    44    47    58  
   44    47    58  
   45    46    49    50    56    51    58    60  
   47    48    52    53    54    55    58  
   46    49    50    56    57    51    58    59    63    60    61    62  
   49    50    56    51    58    60  
   48    52    53    54    55  
   52    53    54    55  
   50    56    57    51    58    60    61    62  
   56    57    51    60    61    62  
   58    59    63    64    65    60    56    57  
   53    54    55  
   54    55  
   55  
    0  
   57    58    59    63    60    61    62  
   58    60  
   59    63    64    65  
   63    64    65  
   61    62  
   62  
    0  
   64    65  
   65  
    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   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   42   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   43   3.6000   0.3550  -0.324000   2.0300   1.8000   0.025682759  -1.666211680
   44   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   45   3.5000   0.0660   0.219000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   47   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   49   3.5000   0.0660   0.163900   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.2500   0.1700  -0.445000   1.8100   1.6000   0.054801302  -1.445846770
   52   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   54   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   55   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   56   3.7500   0.1050   0.629000   1.9250   1.7000   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.506500   1.5250   1.4250   0.001000000  -1.480495490
   58   3.5000   0.0660   0.040000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   60   3.3000   0.1700  -0.943900   1.8650   1.6500   0.051222218  -2.220205820
   61   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   62   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   63   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   64   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   65   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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   268.000  1.529
   33    58   268.000  1.529
   33    40   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    43   222.000  1.810
   43    45   200.000  1.824
   45    46   340.000  1.090
   45    49   268.000  1.529
   45    51   305.000  1.456
   49    50   340.000  1.090
   49    56   250.000  1.540
   49    60   305.000  1.456
   56    57   930.000  1.212
   56    51   440.000  1.369
   51    58   337.000  1.449
   58    59   340.000  1.090
   58    63   317.000  1.522
   63    64   656.000  1.250
   63    65   656.000  1.250
   60    61   434.000  1.010
   60    62   434.000  1.010
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    44   320.000  1.410
   44    47   214.000  1.327
   47    48   570.000  1.229
   47    52   317.000  1.522
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  111.63000
   29    33    58    75.00000  108.68000
   29    33    40    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    43    75.00000  111.63000
   33    58    51    80.00000  109.70000
   33    58    59    37.50000  110.70000
   33    58    63    63.00000  111.10000
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    44    50.00000  109.50000
   37    43    45    85.00000   99.86700
   39    37    38    33.00000  107.80000
   43    37    38    35.00000  109.50000
   43    37    39    35.00000  109.50000
   43    45    46    45.00000  109.41400
   43    45    49    65.00000  119.05700
   43    45    51    80.00000  108.62000
   45    49    50    37.50000  110.70000
   45    49    56   100.00000   86.36000
   45    49    60    65.00000  120.10000
   45    51    56   100.00000   93.00000
   45    51    58    50.00000  132.70000
   49    45    46    37.50000  110.70000
   49    56    57    60.00000  136.58000
   49    56    51    95.00000   92.72400
   49    60    61    50.00000  110.07900
   49    60    62    50.00000  110.07900
   56    49    50    40.00000  113.37500
   56    51    58    50.00000  132.10000
   51    45    46    50.00000  112.01000
   51    45    49   105.00000   87.49700
   51    56    57    75.00000  131.60000
   51    58    59    35.00000  109.50000
   51    58    63    63.00000  110.10000
   58    33    37    58.35000  112.70000
   58    63    64    70.00000  117.00000
   58    63    65    70.00000  117.00000
   63    58    59    35.00000  109.50000
   65    63    64    80.00000  126.00000
   60    49    50    50.00000  107.60000
   60    49    56    80.00000  109.96600
   62    60    61    43.60000  106.40000
   40    33    37    58.35000  112.70000
   40    33    58    58.35000  112.70000
   40    44    47    83.00000  116.90000
   42    40    41    33.00000  107.80000
   44    40    41    35.00000  109.50000
   44    40    42    35.00000  109.50000
   44    47    48    83.00000  123.40000
   44    47    52    81.00000  111.40000
   47    52    53    35.00000  109.50000
   47    52    54    35.00000  109.50000
   47    52    55    35.00000  109.50000
   52    47    48    80.00000  120.40000
   54    52    53    33.00000  107.80000
   55    52    53    33.00000  107.80000
   55    52    54    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    58   0.01700  1.0 1.0
   24    29    33    58  -0.23550 -1.0 2.0
   24    29    33    58   0.21350  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    43   0.56750  1.0 1.0
   29    33    37    43  -0.07550 -1.0 2.0
   29    33    37    43   0.20000  1.0 3.0
   29    33    58    51   0.71400  1.0 1.0
   29    33    58    51   0.04300 -1.0 2.0
   29    33    58    51   0.01450  1.0 3.0
   29    33    58    59   0.15000  1.0 3.0
   29    33    58    63  -2.17200  1.0 1.0
   29    33    58    63  -0.85700 -1.0 2.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    42   0.15000  1.0 3.0
   29    33    40    44   0.56750  1.0 1.0
   29    33    40    44  -0.07550 -1.0 2.0
   29    33    40    44   0.20000  1.0 3.0
   33    37    43    45  -0.25000 -1.0 2.0
   33    37    43    45  -0.01800  1.0 3.0
   33    58    63    64   0.00000  1.0 1.0
   33    58    63    65   0.00000  1.0 1.0
   33    40    44    47  -0.25900  1.0 1.0
   33    40    44    47  -0.47000 -1.0 2.0
   33    40    44    47   0.11750  1.0 3.0
   37    33    58    51   0.42250  1.0 1.0
   37    33    58    51  -0.48100 -1.0 2.0
   37    33    58    51   0.35650  1.0 3.0
   37    33    58    59   0.15000  1.0 3.0
   37    33    58    63  -0.84850  1.0 1.0
   37    33    58    63  -0.22800 -1.0 2.0
   37    33    58    63   0.29250  1.0 3.0
   37    33    40    41   0.15000  1.0 3.0
   37    33    40    42   0.15000  1.0 3.0
   37    33    40    44   0.62750  1.0 1.0
   37    33    40    44  -0.30950 -1.0 2.0
   37    33    40    44   0.27300  1.0 3.0
   37    43    45    46   0.00000  1.0 1.0
   37    43    45    49   0.25150  1.0 1.0
   37    43    45    49  -1.17200 -1.0 2.0
   37    43    45    49   0.53050  1.0 3.0
   37    43   -45    51   0.01700  1.0 1.0
   37    43   -45    51  -0.23550 -1.0 2.0
   37    43   -45    51   0.21350  1.0 3.0
   38    37    43    45   0.32350  1.0 3.0
   39    37    43    45   0.32350  1.0 3.0
   43    45    49    50   0.00000  1.0 1.0
   43    45    49    56   0.00000  1.0 1.0
   43    45    49    60   0.00000  1.0 1.0
   43    45   -51    56   0.00000  1.0 1.0
   43    45    51    58   0.00000  1.0 1.0
   45    49    56    57  -0.11250  1.0 1.0
   45    49    56    57   0.11400 -1.0 2.0
   45    49    56    57  -0.28950  1.0 3.0
   45    49   -56    51   3.00000 -1.0 2.0
   45    49    60    61  -0.05950  1.0 1.0
   45    49    60    61   0.08850 -1.0 2.0
   45    49    60    61   0.11750  1.0 3.0
   45    49    60    62  -0.05950  1.0 1.0
   45    49    60    62   0.08850 -1.0 2.0
   45    49    60    62   0.11750  1.0 3.0
   45    51   -58    33   0.00000  1.0 1.0
   45    51    58    59   0.00000  1.0 1.0
   45    51    58    63   0.00000  1.0 1.0
   46    45    49    50   0.15000  1.0 3.0
   46    45    49    56   0.15000  1.0 3.0
   46    45    49    60   0.15000  1.0 3.0
   46    45   -51    56   0.00000  1.0 1.0
   46    45    51    58   0.00000  1.0 1.0
   49    45   -51    56   0.00000  1.0 1.0
   49    45    51    58   0.00000  1.0 1.0
   49    56   -51    45   3.00000 -1.0 2.0
   49    56   -51    58   3.00000 -1.0 2.0
   50    49    56    57   0.00000  1.0 1.0
   50    49    56    51   0.00000  1.0 1.0
   50    49    60    61   0.20000  1.0 3.0
   50    49    60    62   0.20000  1.0 3.0
   56    49    60    61   0.21900  1.0 1.0
   56    49    60    61  -0.24900 -1.0 2.0
   56    49    60    61   0.15200  1.0 3.0
   56    49    60    62   0.21900  1.0 1.0
   56    49    60    62  -0.24900 -1.0 2.0
   56    49    60    62   0.15200  1.0 3.0
   56    51    58    33   0.00000  1.0 1.0
   56    51    58    59   0.00000  1.0 1.0
   56    51    58    63   0.00000  1.0 1.0
   57    56   -51    45   3.00000 -1.0 2.0
   57    56    51    58   3.00000 -1.0 2.0
   51    45   -49    50   0.15000  1.0 3.0
   51    45   -49    56   3.00000 -1.0 2.0
   51    45    49    60   2.65250  1.0 1.0
   51    45    49    60   0.86150 -1.0 2.0
   51    58    63    64   0.00000  1.0 1.0
   51    58    63    65   0.00000  1.0 1.0
   58    33    37    38   0.15000  1.0 3.0
   58    33    37    39   0.15000  1.0 3.0
   58    33   -37    43   0.44750  1.0 1.0
   58    33   -37    43  -0.17800 -1.0 2.0
   58    33   -37    43   0.20200  1.0 3.0
   58    33    40    41   0.15000  1.0 3.0
   58    33    40    42   0.15000  1.0 3.0
   58    33    40    44   0.62750  1.0 1.0
   58    33    40    44  -0.30950 -1.0 2.0
   58    33    40    44   0.27300  1.0 3.0
   59    58    63    64   0.00000  1.0 1.0
   59    58    63    65   0.00000  1.0 1.0
   60    49    56    57   0.30150 -1.0 2.0
   60    49   -56    51   0.00000  1.0 1.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    43   0.44750  1.0 1.0
   40    33    37    43  -0.17800 -1.0 2.0
   40    33    37    43   0.20200  1.0 3.0
   40    33    58    51   0.42250  1.0 1.0
   40    33    58    51  -0.48100 -1.0 2.0
   40    33    58    51   0.35650  1.0 3.0
   40    33    58    59   0.15000  1.0 3.0
   40    33    58    63  -0.84850  1.0 1.0
   40    33    58    63  -0.22800 -1.0 2.0
   40    33    58    63   0.29250  1.0 3.0
   40    44    47    48   3.00000 -1.0 2.0
   40    44    47    52   1.63150  1.0 1.0
   40    44    47    52   2.92000 -1.0 2.0
   41    40    44    47   0.08050  1.0 3.0
   42    40    44    47   0.08050  1.0 3.0
   44    47    52    53   0.00000  1.0 1.0
   44    47    52    54   0.00000  1.0 1.0
   44    47    52    55   0.00000  1.0 1.0
   48    47    52    53   0.00000  1.0 1.0
   48    47    52    54   0.00000  1.0 1.0
   48    47    52    55   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
   35    30    34    36  10.50000 -1.0 2.0
   49    51    56    57  10.50000 -1.0 2.0
   58    56    51    45   1.00000 -1.0 2.0
   64    58    63    65  10.50000 -1.0 2.0
   44    52    47    48  10.50000 -1.0 2.0
END
