* LIGAND DATABASE FILE (OPLS2005)
*
001      65    66    116    178     340
    1     0 S   NP   _N1_     1    30.32149    91.04866   -19.15661
    2     1 S   H    _HN1     2     1.02869   102.78658   112.62901
    3     1 S   H    _H1_     3     1.02690    14.96525     2.56796
    4     1 S   H    _H2_     4     1.03997   121.97254    -6.21035
    5     1 S   CT   _CA1     5     1.49908   101.38530  -132.66328
    6     5 S   HC   _HA1     6     1.09578   105.37442    64.66044
    7     5 S   CO3  _C1_     7     1.53715   112.40799   -55.71854
    8     7 S   O2Z  _O11     8     1.26376   115.15807   -49.89294
    9     7 S   O2Z  _O12     9     1.26277   114.94945   129.60562
   10     5 S   CT   _CB1    10     1.52948   107.38536  -177.83526
   11    10 S   HC   HB11    11     1.09654   108.60527   -56.35294
   12    10 S   HC   HB12    12     1.09792   110.49677    59.94486
   13    10 S   CT   _CG1    13     1.52854   113.50517  -176.62733
   14    13 S   HC   HG11    14     1.09558   111.28162   -66.35737
   15    13 S   HC   HG12    15     1.09598   110.72658    53.00184
   16    13 S   C    _CD1    16     1.51470   110.00026   172.44345
   17    16 S   O    _OE1    17     1.22851   121.69216   -96.58776
   18    16 S   N    _N2_    18     1.38476   113.16342    82.16198
   19    18 S   H    _HN2    19     1.01578   119.08545     4.30543
   20    18 S   CT1  _CA2    20     1.46143   123.25209  -177.91550
   21    20 S   HC   _HA2    21     1.09587   109.17218     7.78061
   22    20 S   C    _C2_    22     1.53483   108.97865  -107.31070
   23    22 S   O    _O2_    23     1.23055   122.15364  -140.61612
   24    20 S   CT   _CB2    32     1.53550   112.05173   129.80668
   25    24 S   HC   HB21    33     1.09661   109.57139    67.85199
   26    24 S   HC   HB22    34     1.09589   110.51014  -175.09959
   27    22 S   N    _N3_    24     1.38474   113.62807    46.69863
   28    27 S   H    _HN3    25     1.01461   119.22202     0.22728
   29    24 S   S    _SG2    35     1.82849   115.44652   -51.80713
   30    27 S   CT   _CA3    26     1.45432   123.06907   174.76613
   31    30 S   HC   HA31    27     1.09548   108.80521    32.03424
   32    30 S   HC   HA32    28     1.09481   107.19030   149.03415
   33    29 S   CT   _C12    36     1.82168   100.45073   -62.62676
   34    33 S   HC   _H11    37     1.09551   108.86515   -67.03870
   35    33 S   HC   _H12    38     1.09231   110.13538    49.88075
   36    30 S   CO3  _C3_    29     1.53014   113.62099   -91.04947
   37    36 S   O2Z  _O31    30     1.26371   115.73868   -35.66587
   38    36 S   O2Z  _O32    31     1.26407   114.74985   145.26279
   39    33 S   CT   _C11    39     1.53419   111.57694   171.67775
   40    39 S   HC   _H6_    40     1.09638   110.24139    58.09586
   41    39 S   CT   _C10    41     1.53238   113.98905   -68.57575
   42    41 S   HC   _H5_    42     1.09359   112.89292    31.45838
   43    41 S   CT   _C9_    43     1.52116   102.12816   -89.20131
   44    43 S   HC   _H4_    44     1.09545   109.68015    80.24396
   45    41 S   OS   _O35    62     1.43255   108.43513   155.66667
   46    43 S   CO   _C8_    45     1.52435   101.66097   -37.45914
   47    46 S   HC   _H3_    46     1.09658   110.40884   -81.72676
   48    43 S   OH   _O38    60     1.41576   114.03688  -158.52565
   49    48 S   HO   _H13    61     0.98003   107.71320    -2.69878
   50    45 S   PR   _P1_    63     1.62208   117.52046  -132.28263
   51    50 S   OM   _O37    64     1.63887    97.75020  -163.51619
   52    50 S   OM   _O36    65     1.64421    98.25231   -64.65179
   53    46 S   N*   _N4_    47     1.47032   113.13446   156.02495
   54    39 S   OS   _O34    59     1.45054   107.38802   173.97549
   55    53 S   CNA  _C5_    48     1.37846   119.98205   -76.71788
   56    55 S   HC   _H8_    49     1.08298   117.51610    -1.46927
   57    55 S   CM   _C4_    50     1.33131   122.05589   178.27978
   58    57 S   HC   _H7_    51     1.08138   123.11669  -179.86878
   59    57 S   CDX  _C7_    52     1.48225   116.34073     0.00000
   60    59 S   NNC  _N5_    53     1.30440   121.89661    -0.63980
   61    59 S   NND  _N6_    56     1.37276   118.47677   179.40983
   62    61 S   H    _H9_    57     1.01369   122.33310     0.17583
   63    61 S   H    _H10    58     1.01383   120.22300   179.88809
   64    53 S   C    _C6_    54     1.40894   119.54845   100.32864
   65    64 S   O    _O33    55     1.23182   121.69675     1.23416
  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  13   7  11   7   6  11   5   3
   1   2   1   1   9   2   8   4   7   3   6   5   3   1   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    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    54  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    46    54    45  
   35    39    40    41    54  
   39    40    41    54  
   37    38  
   38  
    0  
   40    41    42    43    44    46    47    53    54    48    45    50  
   41    42    43    46    54    45  
   42    43    44    46    47    53    54    48    49    45    50    51    52  
   43    44    46    54    48    45    50  
   44    46    47    53    55    64    54    48    49    45    50  
   46    47    53    54    48    49    45  
   50    51    52    46    48    54  
   47    53    55    56    57    60    64    65    54    48    49  
   53    55    64    54    48  
   49    53    54  
    0  
   51    52  
   52  
    0  
   55    56    57    58    59    60    64    65    54  
   55    64  
   56    57    58    59    60    64    65    61  
   57    58    59    64  
   58    59    60    64    61    62    63  
   59    60    61  
   60    64    65    61    62    63  
   64    65    61    62    63  
   62    63    64  
   63  
    0  
   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   0.047500   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   0.140000   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   2.9000   0.1400  -1.312500   1.7660   1.5600   0.020110767  -0.896042159
   46   3.5000   0.0660   0.480000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0500   0.100000   1.3810   1.2100   0.008598240   0.268726247
   48   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   49   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   50   3.7400   0.2000   0.937500   2.1070   1.8700   0.005000000   0.000000000
   51   2.9800   0.2000  -0.912500   1.6890   1.4900   0.001000000  -0.126889456
   52   2.9800   0.2000  -0.912500   1.6890   1.4900   0.001000000  -0.126889456
   53   3.2500   0.1700  -0.560000   1.8100   1.6000   0.054801302  -1.445846770
   54   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   55   3.5000   0.0800   0.100000   2.0020   1.7750   0.023028004  -0.852763146
   56   2.5000   0.0500   0.100000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0800  -0.060000   2.0020   1.7750   0.023028004  -0.852763146
   58   2.5000   0.0500   0.100000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0800   0.460000   2.0020   1.7750   0.023028004  -0.852763146
   60   3.2500   0.1700  -0.540000   1.8375   1.6250   0.005000000   0.000000000
   61   3.2500   0.1700  -0.790000   1.8650   1.6500   0.051222218  -2.220205820
   62   0.5000   0.0300   0.370000   0.9960   0.8600   0.030040813  -0.651083722
   63   0.5000   0.0300   0.370000   0.9960   0.8600   0.030040813  -0.651083722
   64   3.7500   0.1050   0.550000   1.9250   1.7000   0.001000000  -0.126889456
   65   2.9600   0.2100  -0.480000   1.5250   1.4250   0.001000000  -1.480495490
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    54   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    46   250.000  1.527
   43    48   320.000  1.410
   46    47   340.000  1.090
   46    53   275.000  1.479
   46    54   320.000  1.380
   53    55   448.000  1.365
   53    64   418.000  1.388
   55    56   367.000  1.080
   55    57   549.000  1.340
   57    58   340.000  1.080
   57    59   427.000  1.433
   59    60   585.000  1.311
   59    61   481.000  1.340
   60    64   457.000  1.358
   64    65   570.000  1.229
   61    62   434.000  1.010
   61    63   434.000  1.010
   48    49   553.000  0.945
   45    50   325.000  1.672
   50    51   325.000  1.672
   50    52   325.000  1.672
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    54    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    54    46    60.00000  109.50000
   41    39    40    37.50000  110.70000
   41    43    44    37.50000  110.70000
   41    43    46    75.00000  109.43000
   41    43    48    50.00000  109.50000
   41    45    50   100.00000  120.50000
   43    41    42    37.50000  110.70000
   43    46    47    45.00000  112.01100
   43    46    53    75.00000  107.44000
   43    46    54    90.00000  108.56700
   43    48    49    55.00000  108.50000
   46    43    44    45.00000  108.72000
   46    53    55    70.00000  121.20000
   46    53    64    70.00000  117.60000
   53    46    47    55.00000  103.44000
   53    55    56    35.00000  119.10000
   53    55    57    70.00000  121.20000
   53    64    60    70.00000  118.60000
   53    64    65    80.00000  120.60000
   55    57    58    35.00000  120.00000
   55    57    59    85.00000  117.00000
   57    55    56    35.00000  119.70000
   57    59    60    70.00000  121.02800
   57    59    61    70.00000  120.10000
   59    57    58    35.00000  123.30000
   59    60    64    70.00000  123.15400
   59    61    62    35.00000  120.00000
   59    61    63    35.00000  120.00000
   60    64    65    80.00000  122.50000
   64    53    55    70.00000  121.60000
   61    59    60    70.00000  119.30000
   63    61    62    35.00000  120.00000
   54    39    40    35.00000  109.50000
   54    39    41    50.00000  109.50000
   54    46    47    35.00000  109.50000
   54    46    53   105.00000  106.22000
   48    43    44    35.00000  109.50000
   48    43    46    90.00000  111.58700
   45    41    42    35.00000  109.50000
   45    41    43    50.00000  109.50000
   45    50    51    45.00000  102.60000
   45    50    52    45.00000  102.60000
   52    50    51    35.00000   94.00000
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    54   0.56750  1.0 1.0
   29    33    39    54  -0.07550 -1.0 2.0
   29    33    39    54   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   0.62750  1.0 1.0
   33    39    41    45  -0.30950 -1.0 2.0
   33    39    41    45   0.27300  1.0 3.0
   33    39    54    46   0.06250  1.0 1.0
   33    39    54    46  -0.01100 -1.0 2.0
   33    39    54    46   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    54   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    54   0.23400  1.0 3.0
   39    41    43    44   0.15000  1.0 3.0
   39    41   -43    46   3.97050  1.0 1.0
   39    41    43    48   0.86500  1.0 1.0
   39    41    43    48  -0.17500 -1.0 2.0
   39    41    43    48   0.20800  1.0 3.0
   39    41    45    50  -2.65550  1.0 1.0
   39    41    45    50  -0.22350 -1.0 2.0
   39    41    45    50   0.24150  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    54    46   0.37050  1.0 3.0
   41    39   -54    46   0.06250  1.0 1.0
   41    39   -54    46  -0.01100 -1.0 2.0
   41    39   -54    46   0.28050  1.0 3.0
   41    43    46    47   0.15000  1.0 3.0
   41    43    46    53  -0.27100  1.0 1.0
   41    43    46    53  -0.01700 -1.0 2.0
   41    43    46    53  -0.48600  1.0 3.0
   41    43   -46    54   0.62750  1.0 1.0
   41    43   -46    54  -0.30950 -1.0 2.0
   41    43   -46    54   0.27300  1.0 3.0
   41    43    48    49  -0.11600  1.0 1.0
   41    43    48    49  -0.09450 -1.0 2.0
   41    43    48    49   0.21250  1.0 3.0
   41    45    50    51   0.05050  1.0 1.0
   41    45    50    51  -1.30700 -1.0 2.0
   41    45    50    51   0.91550  1.0 3.0
   41    45    50    52   0.05050  1.0 1.0
   41    45    50    52  -1.30700 -1.0 2.0
   41    45    50    52   0.91550  1.0 3.0
   42    41    43    44   0.15000  1.0 3.0
   42    41    43    46   0.15000  1.0 3.0
   42    41    43    48   0.23400  1.0 3.0
   42    41    45    50   0.03000  1.0 3.0
   43    41    45    50  -2.65550  1.0 1.0
   43    41    45    50  -0.22350 -1.0 2.0
   43    41    45    50   0.24150  1.0 3.0
   43    46    53    55   2.08450  1.0 1.0
   43    46    53    55  -0.39300 -1.0 2.0
   43    46    53    55   0.23400  1.0 3.0
   43    46    53    64  -0.43950  1.0 1.0
   43    46    53    64  -0.08100 -1.0 2.0
   43    46    53    64   0.03350  1.0 3.0
   43    46   -54    39   0.06250  1.0 1.0
   43    46   -54    39  -0.01100 -1.0 2.0
   43    46   -54    39   0.28050  1.0 3.0
   44    43    46    47   0.15000  1.0 3.0
   44    43    46    53   0.15000  1.0 3.0
   44    43    46    54   0.23400  1.0 3.0
   44    43    48    49   0.19450  1.0 3.0
   46    43    48    49  -0.11600  1.0 1.0
   46    43    48    49  -0.09450 -1.0 2.0
   46    43    48    49   0.21250  1.0 3.0
   46    53    55    56   1.88100 -1.0 2.0
   46    53    55    57  -0.88150  1.0 1.0
   46    53    55    57   2.95600 -1.0 2.0
   46    53    64    60   3.62500 -1.0 2.0
   46    53    64    65   3.04450 -1.0 2.0
   47    46    53    55   0.00000  1.0 1.0
   47    46    53    64   0.00000  1.0 1.0
   47    46    54    39   0.37050  1.0 3.0
   53    46    54    39  -2.37750  1.0 1.0
   53    46    54    39  -0.08150 -1.0 2.0
   53    46    54    39   0.59000  1.0 3.0
   53    55    57    58   0.97550 -1.0 2.0
   53    55    57    59   7.00000 -1.0 2.0
   55    53    64    60   3.62500 -1.0 2.0
   55    53    64    65   2.67200 -1.0 2.0
   55    57   -59    60   7.00000 -1.0 2.0
   55    57    59    61   7.00000 -1.0 2.0
   56    55    57    58   7.00000 -1.0 2.0
   56    55    57    59   7.00000 -1.0 2.0
   57    59    60    64   3.62500 -1.0 2.0
   57    59    61    62   0.70000 -1.0 2.0
   57    59    61    63   0.70000 -1.0 2.0
   58    57    59    60   7.00000 -1.0 2.0
   58    57    59    61   7.00000 -1.0 2.0
   59    60   -64    53   3.62500 -1.0 2.0
   59    60    64    65   3.04450 -1.0 2.0
   60    59    61    62   0.70000 -1.0 2.0
   60    59    61    63   0.70000 -1.0 2.0
   64    53    55    56   1.44600  1.0 1.0
   64    53   -55    57  -0.18900  1.0 1.0
   64    53   -55    57   1.70900 -1.0 2.0
   61    59    60    64   3.62500 -1.0 2.0
   54    39    41    42   0.23400  1.0 3.0
   54    39   -41    43   0.62750  1.0 1.0
   54    39   -41    43  -0.30950 -1.0 2.0
   54    39   -41    43   0.27300  1.0 3.0
   54    39    41    45   1.11900  1.0 1.0
   54    39    41    45  -1.16350 -1.0 2.0
   54    39    41    45  -0.34150  1.0 3.0
   54    46    53    55  -0.28000  1.0 1.0
   54    46    53    55  -1.16550 -1.0 2.0
   54    46    53    64  -2.75650  1.0 1.0
   54    46    53    64  -1.18150 -1.0 2.0
   54    46    53    64   0.81900  1.0 3.0
   48    43    46    47   0.23400  1.0 3.0
   48    43    46    53   2.76900  1.0 1.0
   48    43    46    53  -0.24350 -1.0 2.0
   48    43    46    53  -0.78250  1.0 3.0
   48    43    46    54   3.69350  1.0 1.0
   48    43    46    54  -1.82950 -1.0 2.0
   45    41    43    44   0.23400  1.0 3.0
   45    41    43    46   0.62750  1.0 1.0
   45    41    43    46  -0.30950 -1.0 2.0
   45    41    43    46   0.27300  1.0 3.0
   45    41    43    48   3.69350  1.0 1.0
   45    41    43    48  -1.82950 -1.0 2.0
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
   55    64    53    46   1.00000 -1.0 2.0
   53    56    55    57   1.10000 -1.0 2.0
   59    58    57    55   1.10000 -1.0 2.0
   61    57    59    60  10.50000 -1.0 2.0
   53    60    64    65  10.50000 -1.0 2.0
   63    59    61    62   1.00000 -1.0 2.0
END
