* LIGAND DATABASE FILE (OPLS2005)
*
001      63    64    113    177     334
    1     0 S   NP   _N1_     1    28.88567    95.21485   -20.63722
    2     1 S   H    _HN1     2     1.02960    90.75833    37.92942
    3     1 S   H    _H1_     3     1.02837    34.55398   157.76702
    4     1 S   H    _H2_     4     1.02778    85.14330   -70.38061
    5     1 S   CT   _CA1     5     1.50078   145.06102   166.85023
    6     5 S   HC   _HA1     6     1.09578   105.26789    53.62531
    7     5 S   CO3  _C1_     7     1.53741   112.42814   -66.59604
    8     7 S   O2Z  _O11     8     1.26340   115.05280   -44.89378
    9     7 S   O2Z  _O12     9     1.26251   114.88517   134.52709
   10     5 S   CT   _CB1    10     1.53097   107.46015   171.48090
   11    10 S   HC   HB11    11     1.09817   109.26491   -52.13755
   12    10 S   HC   HB12    12     1.09824   110.42776    64.37138
   13    10 S   CT   _CG1    13     1.53005   112.68656  -173.35846
   14    13 S   HC   HG11    14     1.09614   110.29780   -63.22365
   15    13 S   HC   HG12    15     1.09639   110.12132    55.97746
   16    13 S   C    _CD1    16     1.51803   112.31924   176.23246
   17    16 S   O    _OE1    17     1.22715   123.25271    -8.51359
   18    16 S   N    _N2_    18     1.38606   111.60581   172.01330
   19    18 S   H    _HN2    19     1.01585   118.97669     1.15097
   20    18 S   CT1  _CA2    20     1.46234   123.46605  -178.63685
   21    20 S   HC   _HA2    21     1.09732   109.39798   -14.47268
   22    20 S   C    _C2_    22     1.53416   108.16351  -130.16676
   23    22 S   O    _O2_    23     1.23006   122.29436  -144.90636
   24    20 S   CT   _CB2    32     1.53434   111.30110   107.73314
   25    24 S   HC   HB21    33     1.09499   109.68687    54.18002
   26    24 S   HC   HB22    34     1.09515   110.57008   172.89361
   27    22 S   N    _N3_    24     1.38522   113.30640    42.37566
   28    27 S   H    _HN3    25     1.01532   118.91647    -0.50202
   29    24 S   S    _SG2    35     1.82786   111.77302   -67.71052
   30    27 S   CT   _CA3    26     1.45455   123.45376   175.12633
   31    30 S   HC   HA31    27     1.09523   109.24223    24.18812
   32    30 S   HC   HA32    28     1.09496   107.11617   141.20046
   33    29 S   CT   _C12    36     1.82666    99.61818   165.74009
   34    33 S   HC   _H10    37     1.09453   108.93412    42.76157
   35    33 S   HC   _H11    38     1.09506   106.03990   159.01933
   36    30 S   CO3  _C3_    29     1.52931   113.13015   -99.28941
   37    36 S   O2Z  _O31    30     1.26402   115.41695   -43.88724
   38    36 S   O2Z  _O32    31     1.26357   114.97258   137.04739
   39    33 S   CT   _C11    39     1.52704   111.82859   -80.82935
   40    39 S   HC   _H6_    40     1.09690   111.23906    49.13050
   41    39 S   CT   _C10    41     1.52930   114.73001   172.84558
   42    41 S   HC   _H5_    42     1.09429   113.33391   -80.58677
   43    41 S   CT   _C9_    43     1.52076   100.77491   158.54043
   44    43 S   HC   _H4_    44     1.09900   108.79905    77.36362
   45    41 S   OH   _O36    62     1.42553   110.84370    41.77876
   46    45 S   HO   _H12    63     0.97226   107.78577   -78.31974
   47    43 S   CO   _C8_    45     1.53116   101.38166   -40.03477
   48    47 S   HC   _H3_    46     1.09683   110.46702   -85.19993
   49    43 S   NZA  _N6_    59     1.46607   111.51495  -159.57703
   50    47 S   N*   _N4_    47     1.46873   113.35035   152.21055
   51    39 S   OS   _O35    58     1.44538   109.83332   -68.85064
   52    49 S   NZC  _N7_    60     1.24484   116.32797  -155.32182
   53    52 S   NZT  _N8_    61     1.14034   179.90721   149.36833
   54    50 S   CM   _C5_    48     1.38290   119.82901   -75.96191
   55    54 S   HC   _H8_    49     1.08458   116.93725    -1.53544
   56    54 S   CM   _C4_    50     1.33457   123.17194   178.28263
   57    56 S   HC   _H7_    51     1.08265   122.21012  -179.96574
   58    56 S   C    _C7_    52     1.47421   119.31179     0.01978
   59    58 S   O    _O34    53     1.22669   121.14959  -179.43455
   60    58 S   NNB  _N5_    54     1.38124   114.72313    -0.00000
   61    60 S   H    _H9_    55     1.01439   116.71146  -179.74821
   62    50 S   C    _C6_    56     1.40408   118.95396   101.76910
   63    62 S   O    _O33    57     1.23240   124.45699     0.66264
  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  12   7   4   1  11   5
   4  10   2   1   1   8   4   6   3   5   3   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    51  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    47    51    45  
   35    39    40    41    51  
   39    40    41    51  
   37    38  
   38  
    0  
   40    41    42    43    44    47    48    50    51    49    45    46  
   41    42    43    47    51    45  
   42    43    44    47    48    50    51    49    52    45    46  
   43    44    47    51    49    45    46  
   44    47    48    50    54    62    51    49    52    53    45    46  
   47    48    50    51    49    52    45  
   46    47    49    51  
    0  
   48    50    54    55    56    60    62    63    51    49    52  
   50    54    62    51    49  
   52    53    50    51  
   54    55    56    57    58    60    61    62    63    51  
   54    62  
   53  
    0  
   55    56    57    58    59    60    62    63  
   56    57    58    62  
   57    58    59    60    61    62  
   58    59    60  
   59    60    61    62    63  
   60    61    62  
   61    62    63  
   62    63  
   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   0.047500   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   0.187300   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   0.510000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0500   0.100000   1.3810   1.2100   0.008598240   0.268726247
   49   3.1800   0.2500  -0.547100   1.7990   1.5900   0.005000000   0.000000000
   50   3.2500   0.1700  -0.600000   1.8100   1.6000   0.054801302  -1.445846770
   51   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   52   3.1800   0.2500   0.609100   2.2900   2.0360   0.003973653   1.685851020
   53   3.1800   0.2500  -0.309300   1.7990   1.5900   0.005000000   0.000000000
   54   3.5000   0.0800   0.080000   2.0020   1.7750   0.023028004  -0.852763146
   55   2.5000   0.0500   0.100000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0800  -0.070000   2.0020   1.7750   0.023028004  -0.852763146
   57   2.5000   0.0500   0.100000   1.4250   1.2500   0.008598240   0.268726247
   58   3.7500   0.1050   0.450000   1.9250   1.7000   0.001000000  -0.126889456
   59   2.9600   0.2100  -0.420000   1.5250   1.4250   0.001000000  -1.480495490
   60   3.2500   0.1700  -0.510000   1.8100   1.6000   0.054801302  -1.445846770
   61   0.5000   0.0300   0.360000   1.5900   1.4000   0.030040813  -0.651083722
   62   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   63   2.9600   0.2100  -0.400000   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    51   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   280.000  1.455
   47    48   340.000  1.090
   47    50   275.000  1.479
   47    51   320.000  1.380
   50    54   448.000  1.365
   50    62   418.000  1.388
   54    55   340.000  1.080
   54    56   549.000  1.340
   56    57   340.000  1.080
   56    58   410.000  1.444
   58    59   570.000  1.229
   58    60   418.000  1.388
   60    61   434.000  1.010
   60    62   418.000  1.388
   62    63   570.000  1.229
   49    52   555.000  1.236
   52    53   920.000  1.138
   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    51    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    51    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    75.00000  111.50000
   41    45    46    55.00000  108.50000
   43    41    42    37.50000  110.70000
   43    47    48    45.00000  112.01100
   43    47    50    75.00000  107.44000
   43    47    51    90.00000  108.56700
   43    49    52    85.00000  115.26000
   47    43    44    45.00000  108.72000
   47    50    54    70.00000  121.20000
   47    50    62    70.00000  117.60000
   50    47    48    55.00000  103.44000
   50    54    55    35.00000  119.10000
   50    54    56    70.00000  121.20000
   50    62    60    70.00000  118.60000
   50    62    63    80.00000  120.60000
   54    56    57    35.00000  120.00000
   54    56    58    70.00000  118.70000
   56    54    55    35.00000  120.00000
   56    58    59    80.00000  125.30000
   56    58    60    70.00000  114.10000
   58    56    57    35.00000  119.70000
   58    60    61    35.00000  116.80000
   58    60    62    70.00000  126.40000
   60    58    59    80.00000  120.60000
   60    62    63    80.00000  120.60000
   62    50    54    70.00000  121.60000
   62    60    61    35.00000  116.80000
   51    39    40    35.00000  109.50000
   51    39    41    50.00000  109.50000
   51    47    48    35.00000  109.50000
   51    47    50   105.00000  106.22000
   49    43    44    50.00000  111.08000
   49    43    47    75.00000  111.50000
   49    52    53    50.00000  173.69900
   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    51   0.56750  1.0 1.0
   29    33    39    51  -0.07550 -1.0 2.0
   29    33    39    51   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    51    47   0.06250  1.0 1.0
   33    39    51    47  -0.01100 -1.0 2.0
   33    39    51    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    51   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    51   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   0.56750  1.0 1.0
   39    41    43    49  -0.07550 -1.0 2.0
   39    41    43    49   0.20000  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    51    47   0.37050  1.0 3.0
   41    39   -51    47   0.06250  1.0 1.0
   41    39   -51    47  -0.01100 -1.0 2.0
   41    39   -51    47   0.28050  1.0 3.0
   41    43    47    48   0.15000  1.0 3.0
   41    43    47    50  -0.27100  1.0 1.0
   41    43    47    50  -0.01700 -1.0 2.0
   41    43    47    50  -0.48600  1.0 3.0
   41    43   -47    51   0.62750  1.0 1.0
   41    43   -47    51  -0.30950 -1.0 2.0
   41    43   -47    51   0.27300  1.0 3.0
   41    43    49    52   0.00000  1.0 1.0
   42    41    43    44   0.15000  1.0 3.0
   42    41    43    47   0.15000  1.0 3.0
   42    41    43    49   0.15000  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    50    54   2.08450  1.0 1.0
   43    47    50    54  -0.39300 -1.0 2.0
   43    47    50    54   0.23400  1.0 3.0
   43    47    50    62  -0.43950  1.0 1.0
   43    47    50    62  -0.08100 -1.0 2.0
   43    47    50    62   0.03350  1.0 3.0
   43    47   -51    39   0.06250  1.0 1.0
   43    47   -51    39  -0.01100 -1.0 2.0
   43    47   -51    39   0.28050  1.0 3.0
   43    49    52    53   0.00000  1.0 1.0
   44    43    47    48   0.15000  1.0 3.0
   44    43    47    50   0.15000  1.0 3.0
   44    43    47    51   0.23400  1.0 3.0
   44    43    49    52   0.15100  1.0 3.0
   47    43    49    52   0.00000  1.0 1.0
   47    50    54    55   1.88100 -1.0 2.0
   47    50    54    56  -0.88150  1.0 1.0
   47    50    54    56   2.95600 -1.0 2.0
   47    50    62    60   3.62500 -1.0 2.0
   47    50    62    63   3.04450 -1.0 2.0
   48    47    50    54   0.00000  1.0 1.0
   48    47    50    62   0.00000  1.0 1.0
   48    47    51    39   0.37050  1.0 3.0
   50    47    51    39  -2.37750  1.0 1.0
   50    47    51    39  -0.08150 -1.0 2.0
   50    47    51    39   0.59000  1.0 3.0
   50    54    56    57   7.00000 -1.0 2.0
   50    54    56    58   7.00000 -1.0 2.0
   54    50    62    60   3.62500 -1.0 2.0
   54    50    62    63   2.67200 -1.0 2.0
   54    56    58    59   1.00000 -1.0 2.0
   54    56   -58    60   1.50000 -1.0 2.0
   55    54    56    57   7.00000 -1.0 2.0
   55    54    56    58   7.00000 -1.0 2.0
   56    58    60    61   1.52500 -1.0 2.0
   56    58    60    62   7.00000 -1.0 2.0
   57    56    58    59   0.00000  1.0 1.0
   57    56    58    60   7.00000 -1.0 2.0
   58    60   -62    50   3.00000 -1.0 2.0
   58    60    62    63   3.04450 -1.0 2.0
   59    58    60    61   2.45000 -1.0 2.0
   59    58    60    62   3.04450 -1.0 2.0
   61    60    62    50   2.56700 -1.0 2.0
   61    60    62    63   2.45000 -1.0 2.0
   62    50    54    55   1.44600  1.0 1.0
   62    50   -54    56  -0.18900  1.0 1.0
   62    50   -54    56   1.70900 -1.0 2.0
   51    39    41    42   0.23400  1.0 3.0
   51    39   -41    43   0.62750  1.0 1.0
   51    39   -41    43  -0.30950 -1.0 2.0
   51    39   -41    43   0.27300  1.0 3.0
   51    39    41    45   3.69350  1.0 1.0
   51    39    41    45  -1.82950 -1.0 2.0
   51    47    50    54  -0.28000  1.0 1.0
   51    47    50    54  -1.16550 -1.0 2.0
   51    47    50    62  -2.75650  1.0 1.0
   51    47    50    62  -1.18150 -1.0 2.0
   51    47    50    62   0.81900  1.0 3.0
   49    43    47    48   0.15000  1.0 3.0
   49    43    47    50   0.56750  1.0 1.0
   49    43    47    50  -0.07550 -1.0 2.0
   49    43    47    50   0.20000  1.0 3.0
   49    43    47    51   0.56750  1.0 1.0
   49    43    47    51  -0.07550 -1.0 2.0
   49    43    47    51   0.20000  1.0 3.0
   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   0.56750  1.0 1.0
   45    41    43    49  -0.07550 -1.0 2.0
   45    41    43    49   0.20000  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
   37    30    36    38  10.50000 -1.0 2.0
   54    62    50    47   1.00000 -1.0 2.0
   50    55    54    56   1.10000 -1.0 2.0
   58    57    56    54   1.10000 -1.0 2.0
   56    60    58    59  10.50000 -1.0 2.0
   61    58    60    62   1.00000 -1.0 2.0
   50    60    62    63  10.50000 -1.0 2.0
END
