* LIGAND DATABASE FILE (OPLS2005)
*
001      67    69    122    195     358
    1     0 S   NP   _N1_     1    28.96616    96.27912   -22.38136
    2     1 S   H    _HN1     2     1.02841    42.13039   174.78624
    3     1 S   H    _H1_     3     1.02798    96.15559   -75.40192
    4     1 S   H    _H2_     4     1.02945    73.06086    31.79825
    5     1 S   CT   _CA1     5     1.50085   147.59165   133.65991
    6     5 S   HC   _HA1     6     1.09617   105.12341    87.64852
    7     5 S   CO3  _C1_     7     1.53807   112.10057   -31.84770
    8     7 S   O2Z  _O11     8     1.26298   115.17654   -56.92682
    9     7 S   O2Z  _O12     9     1.26353   114.92609   122.06169
   10     5 S   CT   _CB1    10     1.53205   107.30338  -155.28507
   11    10 S   HC   HB11    11     1.09816   108.99084   -55.41875
   12    10 S   HC   HB12    12     1.09796   110.73032    61.10245
   13    10 S   CT   _CG1    13     1.52863   112.40544  -176.63070
   14    13 S   HC   HG11    14     1.09506   110.01490   -71.11201
   15    13 S   HC   HG12    15     1.09681   109.91293    47.99580
   16    13 S   C    _CD1    16     1.51797   112.91754   168.67947
   17    16 S   O    _OE1    17     1.22681   123.42443     5.41157
   18    16 S   N    _N2_    18     1.38679   111.36288  -174.37496
   19    18 S   H    _HN2    19     1.01543   118.78609     0.85866
   20    18 S   CT1  _CA2    20     1.46267   123.79012   176.26556
   21    20 S   HC   _HA2    21     1.09726   109.45981     1.37202
   22    20 S   C    _C2_    22     1.53585   108.41860  -114.07454
   23    22 S   O    _O2_    23     1.23051   122.31222  -148.68114
   24    20 S   CT   _CB2    32     1.53304   111.18987   123.77493
   25    24 S   HC   HB21    33     1.09509   109.84098    52.83343
   26    24 S   HC   HB22    34     1.09500   110.78491   171.81376
   27    22 S   N    _N3_    24     1.38332   113.69108    38.72516
   28    27 S   H    _HN3    25     1.01584   119.53890    -3.02440
   29    24 S   S    _SG2    35     1.82685   111.25411   -68.99023
   30    27 S   CT   _CA3    26     1.45279   123.27989   177.33986
   31    30 S   HC   HA31    27     1.09545   107.46566   -66.28791
   32    30 S   HC   HA32    28     1.09556   108.05913    50.18579
   33    29 S   CT   _C4_    36     1.82743    99.54905   163.91498
   34    33 S   HC   _H7_    37     1.09458   109.28770    41.57132
   35    33 S   HC   _H8_    38     1.09539   106.26802   157.85227
   36    30 S   CO3  _C3_    29     1.52969   114.02738   172.23348
   37    36 S   O2Z  _O31    30     1.26380   116.05715    -0.18767
   38    36 S   O2Z  _O32    31     1.26422   114.41731   179.88131
   39    33 S   CT   _C5_    39     1.52810   111.71536   -82.42397
   40    39 S   HC   _H3_    40     1.09672   110.35783    53.76782
   41    39 S   CT   _C6_    41     1.52696   112.49804   177.15648
   42    41 S   HC   _H4_    42     1.09724   110.50393    37.50321
   43    41 S   CT   _C7_    43     1.51968   102.21764   154.08686
   44    43 S   HC   _H5_    44     1.09349   113.19093  -160.09023
   45    41 S   OH   _O37    66     1.41294   111.81726   -83.84531
   46    45 S   HO   _H14    67     0.97261   107.58461  -164.91229
   47    43 S   CO   _C8_    45     1.52929   100.12363   -39.57483
   48    47 S   HC   _H6_    46     1.09745   108.55345   -81.04736
   49    43 S   OH   _O36    64     1.42483   110.28615    79.69354
   50    49 S   HO   _H13    65     0.97332   108.51689   -70.53891
   51    47 S   N*   _N4_    47     1.44375   116.05819   157.19560
   52    39 S   OS   _O33    63     1.44116   110.14266   -65.53111
   53    51 S   CM   _C9_    48     1.38327   127.18198   -78.92197
   54    53 S   CM   _C10    49     1.33689   107.97691  -177.40346
   55    54 S   C    _C11    50     1.45887   120.62002   178.75040
   56    55 S   O    _O34    51     1.22356   123.06815  -179.91607
   57    54 S   N    _N8_    59     1.36192   111.02928    -0.81373
   58    57 S   H    _H12    60     1.01174   125.41771  -179.97202
   59    55 S   N    _N5_    52     1.38873   111.18650     0.17694
   60    59 S   H    _H9_    53     1.01537   117.62576  -178.30130
   61    51 S   C    _C13    61     1.43107   124.23212   102.85863
   62    61 S   O    _O35    62     1.22095   128.47402    -2.02796
   63    59 S   CDX  _C12    54     1.39716   124.34274     1.33149
   64    53 S   NI   _N6_    55     1.36488   126.12504     3.00928
   65    63 S   NE   _N7_    56     1.36604   115.56108   178.35789
   66    65 S   H    _H10    57     1.01274   120.86974  -179.42291
   67    65 S   H    _H11    58     1.01517   121.20368     5.83247
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   7   5   4   3
  10   5   4   2   1   1  12   6  11   7  11   7   4   1  11   5
   3   1  10   2  11  10   9   4   5   2   6   3   2   1   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    52  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    47    52    45  
   35    39    40    41    52  
   39    40    41    52  
   37    38  
   38  
    0  
   40    41    42    43    44    47    48    51    52    49    45    46  
   41    42    43    47    52    45  
   42    43    44    47    48    51    52    49    50    45    46  
   43    44    47    52    49    45    46  
   44    47    48    51    53    61    52    49    50    45    46  
   47    48    51    52    49    50    45  
   46    47    49    52  
    0  
   48    51    53    54    64    57    61    62    52    49    50  
   51    53    61    52    49  
   50    51    52  
    0  
   53    54    55    63    64    57    58    61    62    52  
   53    61  
   54    55    56    59    63    64    65    57    58    61    62  
   55    56    59    60    63    64    57    58    61    62  
   56    59    60    63    64    65    57    58    61  
   59    60    63    57  
   58    61    62    59    64  
   61    62  
   60    63    64    65    66    67  
   63    64    65  
   62    64  
    0  
   64    65    66    67  
   65    66    67  
   66    67  
   67  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   46   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   47   3.5000   0.0660   0.222500   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.100000   1.3810   1.2100   0.008598240   0.268726247
   49   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   50   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   51   3.2500   0.1700  -0.367500   1.8100   1.6000   0.054801302  -1.445846770
   52   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   53   3.5500   0.0760   0.245000   2.0020   1.7750   0.023028004  -0.852763146
   54   3.5500   0.0760   0.065800   2.0020   1.7750   0.023028004  -0.852763146
   55   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   56   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   57   3.2500   0.1700  -0.488600   1.8100   1.6000   0.054801302  -1.445846770
   58   0.5000   0.0300   0.291200   1.5900   1.4000   0.030040813  -0.651083722
   59   3.2500   0.1700  -0.422500   2.1120   1.8750   0.051222218  -2.220205820
   60   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   61   3.7500   0.1050   0.813700   1.9250   1.7000   0.001000000  -0.126889456
   62   2.9600   0.2100  -0.616300   1.5250   1.4250   0.001000000  -1.480495490
   63   3.7500   0.1050   0.546500   2.1120   1.8750   0.001000000  -0.126889456
   64   3.2800   0.1700  -0.481500   1.9250   1.7000   0.054801302  -2.445846770
   65   3.2500   0.1700  -0.785000   2.1120   1.8750   0.051222218  -2.220205820
   66   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   67   0.5000   0.0300   0.360000   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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   268.000  1.529
   39    52   320.000  1.410
   41    42   340.000  1.090
   41    43   268.000  1.529
   41    45   320.000  1.410
   43    44   340.000  1.090
   43    47   250.000  1.527
   43    49   320.000  1.410
   47    48   340.000  1.090
   47    51   275.000  1.479
   47    52   320.000  1.380
   51    53   448.000  1.365
   51    61   418.000  1.388
   53    54   549.000  1.340
   53    64   405.000  1.380
   54    55   410.000  1.444
   54    57   400.000  1.384
   55    56   570.000  1.229
   55    59   490.000  1.335
   59    60   434.000  1.010
   59    63   400.000  1.380
   63    64   650.000  1.285
   63    65   445.000  1.380
   65    66   434.000  1.010
   65    67   434.000  1.010
   57    58   434.000  1.010
   57    61   490.000  1.335
   61    62   570.000  1.229
   49    50   553.000  0.945
   45    46   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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    58.35000  112.70000
   33    39    52    50.00000  109.50000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    37.50000  110.70000
   39    41    43    58.35000  112.70000
   39    41    45    50.00000  109.50000
   39    52    47    60.00000  109.50000
   41    39    40    37.50000  110.70000
   41    43    44    37.50000  110.70000
   41    43    47    75.00000  109.43000
   41    43    49    50.00000  109.50000
   41    45    46    55.00000  108.50000
   43    41    42    37.50000  110.70000
   43    47    48    45.00000  112.01100
   43    47    51    75.00000  107.44000
   43    47    52    90.00000  108.56700
   43    49    50    55.00000  108.50000
   47    43    44    45.00000  108.72000
   47    51    53    70.00000  121.20000
   47    51    61    70.00000  117.60000
   51    47    48    55.00000  103.44000
   51    53    54    70.00000  121.20000
   51    53    64    85.00000  113.56000
   51    61    57    90.00000  111.91700
   51    61    62    80.00000  120.60000
   53    54    55    70.00000  118.70000
   53    54    57    75.00000  120.83300
   53    64    63    70.00000  116.49400
   54    55    56    80.00000  125.30000
   54    55    59    80.00000  111.56200
   54    57    58    45.00000  117.55000
   54    57    61    70.00000  120.89900
   55    59    60    35.00000  119.80000
   55    59    63    70.00000  120.51600
   59    55    56    80.00000  122.90000
   59    63    64    80.00000  119.04400
   59    63    65    85.00000  111.44000
   63    59    60    45.00000  120.05200
   63    65    66    35.00000  119.50000
   63    65    67    35.00000  119.50000
   64    53    54    70.00000  120.83400
   65    63    64    75.00000  124.36500
   67    65    66    35.00000  109.00000
   57    54    55    70.00000  117.92000
   57    61    62    80.00000  122.90000
   61    51    53    70.00000  121.60000
   61    57    58    35.00000  119.80000
   52    39    40    35.00000  109.50000
   52    39    41    50.00000  109.50000
   52    47    48    35.00000  109.50000
   52    47    51   105.00000  106.22000
   49    43    44    35.00000  109.50000
   49    43    47    90.00000  111.58700
   45    41    42    35.00000  109.50000
   45    41    43    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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    35   0.32350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   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    39    40   0.15000  1.0 3.0
   29    33    39    41   0.44750  1.0 1.0
   29    33    39    41  -0.17800 -1.0 2.0
   29    33    39    41   0.20200  1.0 3.0
   29    33    39    52   0.56750  1.0 1.0
   29    33    39    52  -0.07550 -1.0 2.0
   29    33    39    52   0.20000  1.0 3.0
   33    39    41    42   0.15000  1.0 3.0
   33    39    41    43   0.56750  1.0 1.0
   33    39    41    43  -0.07550 -1.0 2.0
   33    39    41    43   0.20000  1.0 3.0
   33    39    41    45   0.86500  1.0 1.0
   33    39    41    45  -0.17500 -1.0 2.0
   33    39    41    45   0.20800  1.0 3.0
   33    39    52    47   0.06250  1.0 1.0
   33    39    52    47  -0.01100 -1.0 2.0
   33    39    52    47   0.28050  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    52   0.23400  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41   0.15000  1.0 3.0
   35    33    39    52   0.23400  1.0 3.0
   39    41    43    44   0.15000  1.0 3.0
   39    41   -43    47   3.97050  1.0 1.0
   39    41    43    49   0.86500  1.0 1.0
   39    41    43    49  -0.17500 -1.0 2.0
   39    41    43    49   0.20800  1.0 3.0
   39    41    45    46  -0.11600  1.0 1.0
   39    41    45    46  -0.09450 -1.0 2.0
   39    41    45    46   0.21250  1.0 3.0
   40    39    41    42   0.15000  1.0 3.0
   40    39    41    43   0.15000  1.0 3.0
   40    39    41    45   0.23400  1.0 3.0
   40    39    52    47   0.37050  1.0 3.0
   41    39   -52    47   0.06250  1.0 1.0
   41    39   -52    47  -0.01100 -1.0 2.0
   41    39   -52    47   0.28050  1.0 3.0
   41    43    47    48   0.15000  1.0 3.0
   41    43    47    51  -0.27100  1.0 1.0
   41    43    47    51  -0.01700 -1.0 2.0
   41    43    47    51  -0.48600  1.0 3.0
   41    43   -47    52   0.62750  1.0 1.0
   41    43   -47    52  -0.30950 -1.0 2.0
   41    43   -47    52   0.27300  1.0 3.0
   41    43    49    50  -0.11600  1.0 1.0
   41    43    49    50  -0.09450 -1.0 2.0
   41    43    49    50   0.21250  1.0 3.0
   42    41    43    44   0.15000  1.0 3.0
   42    41    43    47   0.15000  1.0 3.0
   42    41    43    49   0.23400  1.0 3.0
   42    41    45    46   0.19450  1.0 3.0
   43    41    45    46  -0.11600  1.0 1.0
   43    41    45    46  -0.09450 -1.0 2.0
   43    41    45    46   0.21250  1.0 3.0
   43    47    51    53   2.08450  1.0 1.0
   43    47    51    53  -0.39300 -1.0 2.0
   43    47    51    53   0.23400  1.0 3.0
   43    47    51    61  -0.43950  1.0 1.0
   43    47    51    61  -0.08100 -1.0 2.0
   43    47    51    61   0.03350  1.0 3.0
   43    47   -52    39   0.06250  1.0 1.0
   43    47   -52    39  -0.01100 -1.0 2.0
   43    47   -52    39   0.28050  1.0 3.0
   44    43    47    48   0.15000  1.0 3.0
   44    43    47    51   0.15000  1.0 3.0
   44    43    47    52   0.23400  1.0 3.0
   44    43    49    50   0.19450  1.0 3.0
   47    43    49    50  -0.11600  1.0 1.0
   47    43    49    50  -0.09450 -1.0 2.0
   47    43    49    50   0.21250  1.0 3.0
   47    51    53    54  -0.88150  1.0 1.0
   47    51    53    54   2.95600 -1.0 2.0
   47    51    53    64   3.62500 -1.0 2.0
   47    51    61    57   3.62500 -1.0 2.0
   47    51    61    62   3.04450 -1.0 2.0
   48    47    51    53   0.00000  1.0 1.0
   48    47    51    61   0.00000  1.0 1.0
   48    47    52    39   0.37050  1.0 3.0
   51    47    52    39  -2.37750  1.0 1.0
   51    47    52    39  -0.08150 -1.0 2.0
   51    47    52    39   0.59000  1.0 3.0
   51    53    54    55   7.00000 -1.0 2.0
   51    53   -54    57   7.00000 -1.0 2.0
   51    53    64    63   1.00000 -1.0 2.0
   53    51   -61    57   3.62500 -1.0 2.0
   53    51    61    62   2.67200 -1.0 2.0
   53    54    55    56   1.00000 -1.0 2.0
   53    54    55    59   0.49500  1.0 1.0
   53    54    55    59   1.31600 -1.0 2.0
   53    54    55    59  -0.02300  1.0 3.0
   53    54    57    58   0.78350 -1.0 2.0
   53    54   -57    61  -0.18900  1.0 1.0
   53    54   -57    61   1.70900 -1.0 2.0
   54    53    64    63   1.00000 -1.0 2.0
   54    55    59    60   2.56700 -1.0 2.0
   54    55   -59    63   2.45000 -1.0 2.0
   54    57   -61    51   4.59200  1.0 1.0
   54    57   -61    51   0.41200 -1.0 2.0
   54    57    61    62   2.67200 -1.0 2.0
   55    54    57    58   1.00000 -1.0 2.0
   55    54    57    61  -0.56400  1.0 1.0
   55    54    57    61   0.77500 -1.0 2.0
   55    54    57    61   0.18700  1.0 3.0
   55    59    63    64  -0.56400  1.0 1.0
   55    59    63    64   0.77500 -1.0 2.0
   55    59    63    64   0.18700  1.0 3.0
   55    59    63    65  -0.56400  1.0 1.0
   55    59    63    65   0.77500 -1.0 2.0
   55    59    63    65   0.18700  1.0 3.0
   56    55    59    60   2.45000 -1.0 2.0
   56    55    59    63   2.67200 -1.0 2.0
   59    63   -64    53   6.00000 -1.0 2.0
   59    63    65    66   1.00000 -1.0 2.0
   59    63    65    67   1.00000 -1.0 2.0
   60    59    63    64   1.00000 -1.0 2.0
   60    59    63    65   1.00000 -1.0 2.0
   64    53   -54    55   7.00000 -1.0 2.0
   64    53    54    57   7.00000 -1.0 2.0
   64    63    65    66   1.50000 -1.0 2.0
   64    63    65    67   1.50000 -1.0 2.0
   65    63    64    53   6.00000 -1.0 2.0
   57    54    55    56  -0.52200  1.0 1.0
   57    54    55    56   0.82950 -1.0 2.0
   57    54    55    59   1.50000 -1.0 2.0
   58    57    61    51   2.56700 -1.0 2.0
   58    57    61    62   2.45000 -1.0 2.0
   61    51   -53    54  -0.18900  1.0 1.0
   61    51   -53    54   1.70900 -1.0 2.0
   61    51    53    64  -0.56400  1.0 1.0
   61    51    53    64   0.77500 -1.0 2.0
   61    51    53    64   0.18700  1.0 3.0
   52    39    41    42   0.23400  1.0 3.0
   52    39   -41    43   0.62750  1.0 1.0
   52    39   -41    43  -0.30950 -1.0 2.0
   52    39   -41    43   0.27300  1.0 3.0
   52    39    41    45   3.69350  1.0 1.0
   52    39    41    45  -1.82950 -1.0 2.0
   52    47    51    53  -0.28000  1.0 1.0
   52    47    51    53  -1.16550 -1.0 2.0
   52    47    51    61  -2.75650  1.0 1.0
   52    47    51    61  -1.18150 -1.0 2.0
   52    47    51    61   0.81900  1.0 3.0
   49    43    47    48   0.23400  1.0 3.0
   49    43    47    51   2.76900  1.0 1.0
   49    43    47    51  -0.24350 -1.0 2.0
   49    43    47    51  -0.78250  1.0 3.0
   49    43    47    52   3.69350  1.0 1.0
   49    43    47    52  -1.82950 -1.0 2.0
   45    41    43    44   0.23400  1.0 3.0
   45    41    43    47   0.86500  1.0 1.0
   45    41    43    47  -0.17500 -1.0 2.0
   45    41    43    47   0.20800  1.0 3.0
   45    41    43    49   3.75450  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
   37    30    36    38  10.50000 -1.0 2.0
   53    61    51    47   1.00000 -1.0 2.0
   51    64    53    54   1.10000 -1.0 2.0
   55    57    54    53   1.10000 -1.0 2.0
   54    59    55    56  10.50000 -1.0 2.0
   60    55    59    63   1.00000 -1.0 2.0
   59    65    63    64  10.50000 -1.0 2.0
   67    63    65    66   1.00000 -1.0 2.0
   58    61    57    54   1.00000 -1.0 2.0
   51    57    61    62  10.50000 -1.0 2.0
END
