* LIGAND DATABASE FILE (OPLS2005)
*
001      63    64    120    189     348
    1     0 S   NP   _N1_     1    28.85189    93.54829   -20.56329
    2     1 S   H    _HN1     2     1.02961   100.79439    35.68577
    3     1 S   H    _H1_     3     1.02838    26.81421   142.21930
    4     1 S   H    _H2_     4     1.02779    85.86520   -72.18409
    5     1 S   CT   _CA1     5     1.50091   135.33835   170.01211
    6     5 S   HC   _HA1     6     1.09566   105.31266    46.21568
    7     5 S   CO3  _C1_     7     1.53892   112.27378   -74.17502
    8     7 S   O2Z  _O11     8     1.26358   115.02532   -45.85267
    9     7 S   O2Z  _O12     9     1.26235   114.93591   133.41577
   10     5 S   CT   _CB1    10     1.53105   107.44837   164.24261
   11    10 S   HC   HB11    11     1.09814   109.63356   -49.72170
   12    10 S   HC   HB12    12     1.09825   110.28515    66.88091
   13    10 S   CT   _CG1    13     1.52993   112.54944  -170.81667
   14    13 S   HC   HG11    14     1.09483   110.28574   -56.59454
   15    13 S   HC   HG12    15     1.09609   110.23973    62.46398
   16    13 S   C    _CD1    16     1.51752   112.05878  -177.24515
   17    16 S   O    _OE1    17     1.22736   123.09162   -16.94476
   18    16 S   N    _N2_    18     1.38575   111.74904   163.69292
   19    18 S   H    _HN2    19     1.01589   119.03785     1.73178
   20    18 S   CT1  _CA2    20     1.46259   123.46395  -176.45851
   21    20 S   HC   _HA2    21     1.09728   109.38654   -16.48902
   22    20 S   C    _C2_    22     1.53359   108.26013  -132.34460
   23    22 S   O    _O2_    23     1.23002   122.29996  -145.20238
   24    20 S   CT   _CB2    32     1.53515   111.07810   105.61972
   25    24 S   HC   HB21    33     1.09454   109.39606    54.62798
   26    24 S   HC   HB22    34     1.09502   110.77090   173.25163
   27    22 S   N    _N3_    24     1.38528   113.29098    42.14865
   28    27 S   H    _HN3    25     1.01533   118.91395    -0.48899
   29    24 S   S    _SG2    35     1.82831   111.52966   -67.33554
   30    27 S   CT   _CA3    26     1.45446   123.38241   175.08578
   31    30 S   HC   HA31    27     1.09528   109.14090    25.97857
   32    30 S   HC   HA32    28     1.09492   107.13701   142.97853
   33    29 S   CT   _C7_    36     1.83253   100.29449   158.65275
   34    33 S   HC   _H4_    37     1.09770   106.03359    42.93965
   35    30 S   CO3  _C3_    29     1.52939   113.22222   -97.42586
   36    35 S   O2Z  _O31    30     1.26394   115.46308   -42.76931
   37    35 S   O2Z  _O32    31     1.26364   114.94066   138.17845
   38    33 S   C3T  _C8_    38     1.50513   109.89279   -73.74288
   39    38 S   HC   _H5_    39     1.08862   109.43143    85.73288
   40    38 S   C3T  _C9_    40     1.51162   119.75186  -138.02680
   41    40 S   HC   _H6_    41     1.08691   116.16789  -133.35216
   42    40 S   CO4  _C10    42     1.48344   119.24484     7.12478
   43    42 S   O    _O33    43     1.22430   120.10167   153.58184
   44    38 S   C3T  _C11    55     1.53012   128.12682   -64.61336
   45    42 S   CT   _C5_    44     1.52375   115.10534   -28.29279
   46    44 S   CT   _C12    56     1.50646   122.52226     2.42656
   47    46 S   HC   _H10    57     1.09490   110.25220    81.97378
   48    46 S   HC   _H11    58     1.08934   114.12866   -39.74092
   49    46 S   HC   _H12    59     1.09577   109.87506  -159.50877
   50    44 S   CT   _C13    60     1.51274   116.14809   146.89755
   51    50 S   HC   _H13    61     1.09417   110.23899   -86.33923
   52    50 S   HC   _H14    62     1.09501   110.43609   153.85180
   53    50 S   HC   _H15    63     1.09543   112.13006    33.69169
   54    33 S   CT   _C6_    45     1.54258   109.63591   158.66971
   55    54 S   HC   _H3_    46     1.09541   111.44921    43.13167
   56    45 S   CT   _C4_    49     1.52965   111.31898   177.42215
   57    56 S   HC   _H7_    50     1.09539   111.32630   174.30020
   58    56 S   HC   _H8_    51     1.09648   110.95946    56.24240
   59    56 S   HC   _H9_    52     1.09511   111.52105   -63.98793
   60    45 S   OH   _O35    53     1.42656   106.89406   -64.20668
   61    60 S   HO   _H17    54     0.97284   108.13304   -68.83541
   62    54 S   OH   _O34    47     1.43395   108.72573   -73.78770
   63    62 S   HO   _H16    48     0.97321   107.09107    56.45836
  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
  16   8   2   1   1  18   7  16   6  14   5  10  10   7   3   2
   1   3   2   1   1   9   4   6   3   2   1   2   1   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    54    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    45    54    55    62    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    45    54    55    62    63    56    60    44    46    50  
   38    39    40    45    54    55    62    44  
   36    37  
   37  
    0  
   39    40    41    42    43    45    54    55    62    44    46    47    48    49    50    51    52    53  
   40    41    42    54    44    46    50  
   41    42    43    45    54    56    60    44    46    47    48    49    50    51    52    53  
   42    43    45    44    46    50  
   43    45    54    55    62    56    57    58    59    60    61    44    46    50  
   45    54    56    60    44  
   46    47    48    49    50    51    52    53    45    54  
   54    55    62    63    56    57    58    59    60    61  
   47    48    49    50    51    52    53  
   48    49    50  
   49    50  
   50  
   51    52    53  
   52    53  
   53  
    0  
   55    62    63    56    57    58    59    60    61  
   62    63    56    60  
   57    58    59    60    61    62  
   58    59    60  
   59    60  
   60  
   61    62  
    0  
   63  
    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  -0.060000   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   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   42   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   44   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   45   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   46   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   61   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   62   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   63   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   275.000  1.510
   33    54   268.000  1.529
   38    39   340.000  1.088
   38    40   260.000  1.509
   38    44   260.000  1.509
   40    41   340.000  1.088
   40    42   290.000  1.496
   40    44   260.000  1.509
   42    43   570.000  1.229
   42    45   317.000  1.522
   45    54   268.000  1.529
   45    56   268.000  1.529
   45    60   320.000  1.410
   54    55   340.000  1.090
   54    62   320.000  1.410
   62    63   553.000  0.945
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   340.000  1.090
   60    61   553.000  0.945
   44    46   275.000  1.510
   44    50   275.000  1.510
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    49   340.000  1.090
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   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    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    54    75.00000  111.63000
   33    38    39    40.00000  115.04500
   33    38    40    60.00000  120.94000
   33    38    44    60.00000  120.94000
   33    54    45    58.35000  112.70000
   33    54    55    37.50000  110.70000
   33    54    62    50.00000  109.50000
   38    33    34    45.00000  109.38400
   38    40    41    37.50000  117.20000
   38    40    42    65.00000  117.18000
   38    40    44    10.00000   60.00500
   38    44    40    10.00000   60.00500
   38    44    46    60.00000  120.94000
   38    44    50    60.00000  120.94000
   40    38    39    37.50000  117.20000
   40    42    43    75.00000  121.36600
   40    42    45    65.00000  117.32000
   40    44    46    60.00000  120.94000
   40    44    50    60.00000  120.94000
   42    40    41    40.00000  116.18000
   42    45    54    63.00000  111.10000
   42    45    56    63.00000  111.10000
   42    45    60    90.00000  109.61100
   45    42    43    80.00000  120.40000
   45    54    55    37.50000  110.70000
   45    54    62    50.00000  109.50000
   45    56    57    37.50000  110.70000
   45    56    58    37.50000  110.70000
   45    56    59    37.50000  110.70000
   45    60    61    55.00000  108.50000
   54    33    34    37.50000  110.70000
   54    33    38    70.00000  112.37300
   54    62    63    55.00000  108.50000
   62    54    55    35.00000  109.50000
   56    45    54    58.35000  112.70000
   58    56    57    33.00000  107.80000
   59    56    57    33.00000  107.80000
   59    56    58    33.00000  107.80000
   60    45    54    50.00000  109.50000
   60    45    56    50.00000  109.50000
   44    38    39    37.50000  117.20000
   44    38    40    10.00000   60.00500
   44    40    41    37.50000  117.20000
   44    40    42    65.00000  117.18000
   44    46    47    45.00000  109.38400
   44    46    48    45.00000  109.38400
   44    46    49    45.00000  109.38400
   44    50    51    45.00000  109.38400
   44    50    52    45.00000  109.38400
   44    50    53    45.00000  109.38400
   48    46    47    33.00000  107.80000
   49    46    47    33.00000  107.80000
   49    46    48    33.00000  107.80000
   50    44    46    58.35000  112.70000
   52    50    51    33.00000  107.80000
   53    50    51    33.00000  107.80000
   53    50    52    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   0.32350  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    54   0.01700  1.0 1.0
   24    29    33    54  -0.23550 -1.0 2.0
   24    29    33    54   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    44   0.44750  1.0 1.0
   29    33    38    44  -0.17800 -1.0 2.0
   29    33    38    44   0.20200  1.0 3.0
   29    33    54    45   0.44750  1.0 1.0
   29    33    54    45  -0.17800 -1.0 2.0
   29    33    54    45   0.20200  1.0 3.0
   29    33    54    55   0.15000  1.0 3.0
   29    33    54    62   0.56750  1.0 1.0
   29    33    54    62  -0.07550 -1.0 2.0
   29    33    54    62   0.20000  1.0 3.0
   33    38    40    41   0.15000  1.0 3.0
   33    38    40    42  -0.95700  1.0 1.0
   33    38    40    42  -0.18200 -1.0 2.0
   33    38    40    42   0.29450  1.0 3.0
   33    38   -40    44   0.07850  1.0 1.0
   33    38   -40    44  -0.03950 -1.0 2.0
   33    38   -40    44   0.67350  1.0 3.0
   33    38   -44    40   0.07850  1.0 1.0
   33    38   -44    40  -0.03950 -1.0 2.0
   33    38   -44    40   0.67350  1.0 3.0
   33    38    44    46   0.56750  1.0 1.0
   33    38    44    46  -0.07550 -1.0 2.0
   33    38    44    46   0.20000  1.0 3.0
   33    38    44    50   0.56750  1.0 1.0
   33    38    44    50  -0.07550 -1.0 2.0
   33    38    44    50   0.20000  1.0 3.0
   33    54    62    63  -0.11600  1.0 1.0
   33    54    62    63  -0.09450 -1.0 2.0
   33    54    62    63   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    44   0.15000  1.0 3.0
   34    33    54    45   0.15000  1.0 3.0
   34    33    54    55   0.15000  1.0 3.0
   34    33    54    62   0.23400  1.0 3.0
   38    33    54    45   0.47050  1.0 1.0
   38    33    54    45   0.03900 -1.0 2.0
   38    33    54    45   0.20100  1.0 3.0
   38    33    54    55   0.15000  1.0 3.0
   38    33    54    62   0.86500  1.0 1.0
   38    33    54    62  -0.17500 -1.0 2.0
   38    33    54    62   0.20800  1.0 3.0
   38    40    42    43   0.30150 -1.0 2.0
   38    40   -42    45   0.60050  1.0 1.0
   38    40   -42    45   0.05600 -1.0 2.0
   38    40   -42    45   0.26150  1.0 3.0
   38    40   -44    46   0.07850  1.0 1.0
   38    40   -44    46  -0.03950 -1.0 2.0
   38    40   -44    46   0.67350  1.0 3.0
   38    40   -44    50   0.07850  1.0 1.0
   38    40   -44    50  -0.03950 -1.0 2.0
   38    40   -44    50   0.67350  1.0 3.0
   38    44    46    47   0.15000  1.0 3.0
   38    44    46    48   0.15000  1.0 3.0
   38    44    46    49   0.15000  1.0 3.0
   38    44    50    51   0.15000  1.0 3.0
   38    44    50    52   0.15000  1.0 3.0
   38    44    50    53   0.15000  1.0 3.0
   39    38    40    41   0.15000  1.0 3.0
   39    38    40    42   0.15000  1.0 3.0
   39    38   -40    44   0.15000  1.0 3.0
   39    38   -44    40   0.15000  1.0 3.0
   39    38    44    46   0.15000  1.0 3.0
   39    38    44    50   0.15000  1.0 3.0
   40    38   -44    46   0.07850  1.0 1.0
   40    38   -44    46  -0.03950 -1.0 2.0
   40    38   -44    46   0.67350  1.0 3.0
   40    38   -44    50   0.07850  1.0 1.0
   40    38   -44    50  -0.03950 -1.0 2.0
   40    38   -44    50   0.67350  1.0 3.0
   40    42    45    54   0.60050  1.0 1.0
   40    42    45    54   0.05600 -1.0 2.0
   40    42    45    54   0.26150  1.0 3.0
   40    42    45    56   0.60050  1.0 1.0
   40    42    45    56   0.05600 -1.0 2.0
   40    42    45    56   0.26150  1.0 3.0
   40    42    45    60   0.55300  1.0 1.0
   40    42    45    60   1.25850 -1.0 2.0
   40    42    45    60  -0.23600  1.0 3.0
   40    44    46    47   0.15000  1.0 3.0
   40    44    46    48   0.15000  1.0 3.0
   40    44    46    49   0.15000  1.0 3.0
   40    44    50    51   0.15000  1.0 3.0
   40    44    50    52   0.15000  1.0 3.0
   40    44    50    53   0.15000  1.0 3.0
   41    40    42    43   0.50000  1.0 3.0
   41    40    42    45   0.00000  1.0 1.0
   41    40   -44    38   0.15000  1.0 3.0
   41    40    44    46   0.15000  1.0 3.0
   41    40    44    50   0.15000  1.0 3.0
   42    40   -44    38  -0.95700  1.0 1.0
   42    40   -44    38  -0.18200 -1.0 2.0
   42    40   -44    38   0.29450  1.0 3.0
   42    40    44    46  -0.95700  1.0 1.0
   42    40    44    46  -0.18200 -1.0 2.0
   42    40    44    46   0.29450  1.0 3.0
   42    40    44    50  -0.95700  1.0 1.0
   42    40    44    50  -0.18200 -1.0 2.0
   42    40    44    50   0.29450  1.0 3.0
   42    45   -54    33  -0.95700  1.0 1.0
   42    45   -54    33  -0.18200 -1.0 2.0
   42    45   -54    33   0.29450  1.0 3.0
   42    45    54    55  -0.11250  1.0 3.0
   42    45    54    62  -0.09450  1.0 1.0
   42    45    54    62  -1.12950 -1.0 2.0
   42    45    54    62   0.54000  1.0 3.0
   42    45    56    57  -0.11250  1.0 3.0
   42    45    56    58  -0.11250  1.0 3.0
   42    45    56    59  -0.11250  1.0 3.0
   42    45    60    61   0.91850  1.0 1.0
   42    45    60    61   0.57950  1.0 3.0
   43    42    45    54   0.30150 -1.0 2.0
   43    42    45    56   0.30150 -1.0 2.0
   43    42    45    60   0.30150 -1.0 2.0
   45    54    62    63  -0.11600  1.0 1.0
   45    54    62    63  -0.09450 -1.0 2.0
   45    54    62    63   0.21250  1.0 3.0
   54    33    38    39   0.15000  1.0 3.0
   54    33   -38    40   0.07850  1.0 1.0
   54    33   -38    40  -0.03950 -1.0 2.0
   54    33   -38    40   0.67350  1.0 3.0
   54    33    38    44   0.07850  1.0 1.0
   54    33    38    44  -0.03950 -1.0 2.0
   54    33    38    44   0.67350  1.0 3.0
   54    45    56    57   0.15000  1.0 3.0
   54    45    56    58   0.15000  1.0 3.0
   54    45    56    59   0.15000  1.0 3.0
   54    45    60    61  -0.11600  1.0 1.0
   54    45    60    61  -0.09450 -1.0 2.0
   54    45    60    61   0.21250  1.0 3.0
   55    54    62    63   0.19450  1.0 3.0
   56    45    54    33   0.56750  1.0 1.0
   56    45    54    33  -0.07550 -1.0 2.0
   56    45    54    33   0.20000  1.0 3.0
   56    45    54    55   0.15000  1.0 3.0
   56    45    54    62   0.86500  1.0 1.0
   56    45    54    62  -0.17500 -1.0 2.0
   56    45    54    62   0.20800  1.0 3.0
   56    45    60    61  -0.11600  1.0 1.0
   56    45    60    61  -0.09450 -1.0 2.0
   56    45    60    61   0.21250  1.0 3.0
   60    45    54    33   0.86500  1.0 1.0
   60    45    54    33  -0.17500 -1.0 2.0
   60    45    54    33   0.20800  1.0 3.0
   60    45    54    55   0.23400  1.0 3.0
   60    45    54    62   3.75450  1.0 1.0
   60    45    56    57   0.23400  1.0 3.0
   60    45    56    58   0.23400  1.0 3.0
   60    45    56    59   0.23400  1.0 3.0
   44    38   -40    41   0.15000  1.0 3.0
   44    38   -40    42  -0.95700  1.0 1.0
   44    38   -40    42  -0.18200 -1.0 2.0
   44    38   -40    42   0.29450  1.0 3.0
   44    40    42    43   0.30150 -1.0 2.0
   44    40    42    45   0.60050  1.0 1.0
   44    40    42    45   0.05600 -1.0 2.0
   44    40    42    45   0.26150  1.0 3.0
   46    44    50    51   0.15000  1.0 3.0
   46    44    50    52   0.15000  1.0 3.0
   46    44    50    53   0.15000  1.0 3.0
   50    44    46    47   0.15000  1.0 3.0
   50    44    46    48   0.15000  1.0 3.0
   50    44    46    49   0.15000  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
   40    45    42    43  10.50000 -1.0 2.0
END
