* LIGAND DATABASE FILE (OPLS2005)
*
001      60    60    109    162     319
    1     0 S   NP   _N1_     1    28.71127    97.10608   -22.67950
    2     1 S   H    _HN1     2     1.02948    68.81889     4.83874
    3     1 S   H    _H1_     3     1.02828    42.66702   157.12737
    4     1 S   H    _H2_     4     1.02791   102.71597  -100.17581
    5     1 S   CT   _CA1     5     1.50122   142.60065   101.09701
    6     5 S   HC   _HA1     6     1.09572   105.18210    96.18892
    7     5 S   CO3  _C1_     7     1.53780   112.46021   -24.05216
    8     7 S   O2Z  _O11     8     1.26376   115.00466   -42.53565
    9     7 S   O2Z  _O12     9     1.26235   114.94458   136.54587
   10     5 S   CT   _CB1    10     1.53067   107.41486  -145.81769
   11    10 S   HC   HB11    11     1.09838   109.37037   -49.37432
   12    10 S   HC   HB12    12     1.09812   110.45204    67.22965
   13    10 S   CT   _CG1    13     1.53008   112.62503  -170.31976
   14    13 S   HC   HG11    14     1.09575   110.69186   -66.22771
   15    13 S   HC   HG12    15     1.09669   109.74153    53.02320
   16    13 S   C    _CD1    16     1.51803   112.09451   173.50695
   17    16 S   O    _OE1    17     1.22744   123.22880     9.74033
   18    16 S   N    _N2_    18     1.38650   111.77269  -170.34264
   19    18 S   H    _HN2    19     1.01581   118.96286     1.61180
   20    18 S   CT1  _CA2    20     1.46216   123.37382   177.30325
   21    20 S   HC   _HA2    21     1.09737   109.32281     6.14819
   22    20 S   C    _C2_    22     1.53613   108.78006  -109.41397
   23    22 S   O    _O2_    23     1.23076   122.23511  -148.03310
   24    20 S   CT   _CB2    32     1.53341   111.57792   128.13461
   25    24 S   HC   HB21    33     1.09434   109.90511    57.25187
   26    24 S   HC   HB22    34     1.09524   110.06902   176.12394
   27    22 S   N    _N3_    24     1.38309   113.82190    39.40999
   28    27 S   H    _HN3    25     1.01560   119.63092    -3.11722
   29    24 S   S    _SG2    35     1.82691   111.48935   -64.26284
   30    27 S   CT   _CA3    26     1.45290   123.24444   177.21343
   31    30 S   HC   HA31    27     1.09548   107.50136   -65.05481
   32    30 S   HC   HA32    28     1.09556   108.00505    51.39802
   33    29 S   CT   _C7_    36     1.84834    99.77841  -179.46551
   34    33 S   HC   _H4_    37     1.09552   106.50936    30.96724
   35    30 S   CO3  _C3_    29     1.52968   114.05846   173.41712
   36    35 S   O2Z  _O31    30     1.26380   116.07301    -0.22381
   37    35 S   O2Z  _O32    31     1.26424   114.42027   179.83214
   38    33 S   CT   _C8_    38     1.52808   111.67747   -85.76512
   39    38 S   F    F1__    39     1.36132   110.28177    55.25673
   40    38 S   HC   _H5_    40     1.09754   109.62287   171.91121
   41    38 S   C    _C9_    41     1.50644   112.29866   -69.77393
   42    41 S   O    _O35    42     1.23003   121.94327   150.70606
   43    41 S   N    _N6_    43     1.37363   115.03618   -32.69738
   44    43 S   H    _H12    44     1.01325   116.67089  -176.60327
   45    43 S   CT   _C10    45     1.46309   127.48886     9.84950
   46    45 S   OM   _O36    46     1.31933   103.55161  -130.24502
   47    45 S   HC   _H6_    47     1.09844   103.47237   103.75748
   48    33 S   NT   _N5_    48     1.47558   115.19511   151.63855
   49    48 S   CT   _C4_    49     1.47892   113.22924   -69.16380
   50    49 S   HC   _H7_    50     1.09580   111.50915    36.10652
   51    49 S   HC   _H8_    51     1.09882   111.17359   152.71226
   52    49 S   CT   _C5_    52     1.53609   110.67798   -87.67959
   53    52 S   HC   _H3_    53     1.09638   110.36717    58.63248
   54    52 S   CO3  _C6_    54     1.54064   114.16874   178.66206
   55    54 S   O2Z  _O34    55     1.26594   114.16165   159.94669
   56    54 S   O2Z  _O33    56     1.26095   116.46656   -20.68561
   57    52 S   NP   _N4_    57     1.50494   107.48095   -55.48607
   58    57 S   H    _H9_    58     1.02916   110.73839    54.82483
   59    57 S   H    _H10    59     1.02847   110.90066   -63.97663
   60    57 S   H    _H11    60     1.02788   110.94906   176.19594
  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   9   5   4   3
  15   7   2   1   1   9   5   4   7   3   6   4   7   3   2   7
  11   5   4   8   7   6   2   1   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    48    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    45    48    49  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    45    46    47    48    49    50    51    52  
   38    39    40    41    45    48    49  
   36    37  
   37  
    0  
   39    40    41    42    43    44    45    48    49  
   40    41    42    43    48  
   41    42    43    48  
   42    43    44    45    46    47    48  
   43    44    45  
   44    45    46    47    48    49  
   45    46    47    48  
   46    47    48    49    50    51    52  
   47    48    49  
   48    49  
   49    50    51    52    53    54    57  
   50    51    52    53    54    55    56    57    58    59    60  
   51    52    53    54    57  
   52    53    54    57  
   53    54    55    56    57    58    59    60  
   54    55    56    57    58    59    60  
   55    56    57    58    59    60  
   56    57  
   57  
   58    59    60  
   59    60  
   60  
    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   0.317500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0150   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   0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.9400   0.0610  -0.220000   2.4980   2.2250   0.001000000   0.985400000
   40   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   41   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   43   3.2500   0.1700  -0.422500   2.1120   1.8750   0.051222218  -2.220205820
   44   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   45   4.2000   0.3000   0.165000   1.9750   1.7500   0.005000000  -0.741685710
   46   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   47   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   48   3.3000   0.1700  -0.542500   1.9050   1.6860   0.051222218  -2.220205820
   49   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0150   0.060000   1.6450   1.4500   0.008598240   0.268726247
   51   2.5000   0.0150   0.060000   1.6450   1.4500   0.008598240   0.268726247
   52   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   54   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
   55   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   56   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   57   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
   58   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
   59   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
   60   0.5000   0.0300   0.210000   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   268.000  1.529
   33    48   382.000  1.448
   38    39   367.000  1.332
   38    40   340.000  1.090
   38    41   317.000  1.522
   41    42   570.000  1.229
   41    43   490.000  1.335
   43    44   434.000  1.010
   43    45   337.000  1.449
   45    46   570.000  1.307
   45    47   340.000  1.090
   45    48   382.000  1.448
   48    49   382.000  1.448
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   268.000  1.529
   52    53   340.000  1.090
   52    54   317.000  1.522
   52    57   367.000  1.471
   54    55   656.000  1.250
   54    56   656.000  1.250
   57    58   434.000  1.010
   57    59   434.000  1.010
   57    60   434.000  1.010
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    48    85.00000  109.00000
   33    38    39    50.00000  109.50000
   33    38    40    37.50000  110.70000
   33    38    41    63.00000  111.10000
   33    48    45    51.80000  107.20000
   33    48    49    51.80000  107.20000
   38    33    34    37.50000  110.70000
   38    41    42    80.00000  120.40000
   38    41    43    70.00000  116.60000
   40    38    39    40.00000  107.00000
   41    38    39    90.00000  108.61100
   41    38    40    35.00000  109.50000
   41    43    44    35.00000  119.80000
   41    43    45    50.00000  121.90000
   43    41    42    80.00000  122.90000
   43    45    46    95.00000  111.00000
   43    45    47    35.00000  109.50000
   43    45    48    80.00000  116.76000
   45    43    44    38.00000  118.40000
   45    48    49    51.80000  107.20000
   47    45    46    45.00000  125.66300
   48    33    34    35.00000  109.50000
   48    33    38    56.20000  109.47000
   48    45    46   110.00000  105.70000
   48    45    47    35.00000  109.50000
   48    49    50    35.00000  109.50000
   48    49    51    35.00000  109.50000
   48    49    52    56.20000  109.47000
   49    52    53    37.50000  110.70000
   49    52    54    70.00000  109.69300
   49    52    57    80.00000  111.20000
   51    49    50    33.00000  107.80000
   52    49    50    37.50000  110.70000
   52    49    51    37.50000  110.70000
   52    54    55    70.00000  117.00000
   52    54    56    70.00000  117.00000
   52    57    58    35.00000  109.50000
   52    57    59    35.00000  109.50000
   52    57    60    35.00000  109.50000
   54    52    53    35.00000  109.50000
   56    54    55    80.00000  126.00000
   57    52    53    35.00000  109.50000
   57    52    54    80.00000  109.26000
   59    57    58    35.00000  109.50000
   60    57    58    35.00000  109.50000
   60    57    59    35.00000  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    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    48   0.01700  1.0 1.0
   24    29    33    48  -0.23550 -1.0 2.0
   24    29    33    48   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   0.56750  1.0 1.0
   29    33    38    39  -0.07550 -1.0 2.0
   29    33    38    39   0.20000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.56750  1.0 1.0
   29    33    38    41  -0.07550 -1.0 2.0
   29    33    38    41   0.20000  1.0 3.0
   29    33    48    45   0.23200  1.0 1.0
   29    33    48    45   0.02100 -1.0 2.0
   29    33    48    45   0.24950  1.0 3.0
   29    33    48    49   0.23200  1.0 1.0
   29    33    48    49   0.02100 -1.0 2.0
   29    33    48    49   0.24950  1.0 3.0
   33    38    41    42   0.30150 -1.0 2.0
   33    38    41    43   1.39750  1.0 1.0
   33    38    41    43  -0.07950 -1.0 2.0
   33    38    41    43  -0.18750  1.0 3.0
   33    48    49    50   0.28000  1.0 3.0
   33    48    49    51   0.28000  1.0 3.0
   33    48    49    52   0.23450  1.0 1.0
   33    48    49    52   0.02050 -1.0 2.0
   33    48    49    52   0.25250  1.0 3.0
   34    33    38    39   0.22100  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    41  -0.11250  1.0 3.0
   34    33    48    45   0.28000  1.0 3.0
   34    33    48    49   0.28000  1.0 3.0
   38    33    48    45   0.23450  1.0 1.0
   38    33    48    45   0.02050 -1.0 2.0
   38    33    48    45   0.25250  1.0 3.0
   38    33    48    49   0.58650  1.0 1.0
   38    33    48    49   0.12600 -1.0 2.0
   38    33    48    49   0.33350  1.0 3.0
   38    41    43    44   2.45000 -1.0 2.0
   38    41   -43    45   1.49850  1.0 1.0
   38    41   -43    45   1.53950 -1.0 2.0
   39    38    41    42   0.30150 -1.0 2.0
   39    38    41    43   0.00000  1.0 1.0
   40    38    41    42   0.00000  1.0 1.0
   40    38    41    43   0.00000  1.0 1.0
   41    43    45    46  -2.75650  1.0 1.0
   41    43    45    46  -1.18150 -1.0 2.0
   41    43    45    46   0.81900  1.0 3.0
   41    43    45    47   0.00000  1.0 1.0
   41    43    45    48  -0.42300  1.0 1.0
   41    43    45    48  -0.07000 -1.0 2.0
   41    43    45    48   0.04150  1.0 3.0
   42    41    43    44   2.45000 -1.0 2.0
   42    41    43    45   3.04450 -1.0 2.0
   43    45   -48    33   0.23200  1.0 1.0
   43    45   -48    33   0.02100 -1.0 2.0
   43    45   -48    33   0.24950  1.0 3.0
   43    45    48    49   0.23200  1.0 1.0
   43    45    48    49   0.02100 -1.0 2.0
   43    45    48    49   0.24950  1.0 3.0
   44    43    45    46   0.00000  1.0 1.0
   44    43    45    47   0.00000  1.0 1.0
   44    43    45    48   0.00000  1.0 1.0
   45    48    49    50   0.28000  1.0 3.0
   45    48    49    51   0.28000  1.0 3.0
   45    48    49    52   0.23450  1.0 1.0
   45    48    49    52   0.02050 -1.0 2.0
   45    48    49    52   0.25250  1.0 3.0
   46    45    48    33   0.23200  1.0 1.0
   46    45    48    33   0.02100 -1.0 2.0
   46    45    48    33   0.24950  1.0 3.0
   46    45    48    49   0.23200  1.0 1.0
   46    45    48    49   0.02100 -1.0 2.0
   46    45    48    49   0.24950  1.0 3.0
   47    45    48    33   0.28000  1.0 3.0
   47    45    48    49   0.28000  1.0 3.0
   48    33    38    39   0.56750  1.0 1.0
   48    33    38    39  -0.07550 -1.0 2.0
   48    33    38    39   0.20000  1.0 3.0
   48    33    38    40   0.15000  1.0 3.0
   48    33   -38    41  -3.56550  1.0 1.0
   48    33   -38    41  -0.67500 -1.0 2.0
   48    33   -38    41   1.11300  1.0 3.0
   48    49    52    53   0.15000  1.0 3.0
   48    49    52    54  -3.56550  1.0 1.0
   48    49    52    54  -0.67500 -1.0 2.0
   48    49    52    54   1.11300  1.0 3.0
   48    49    52    57   0.99100  1.0 1.0
   48    49    52    57  -1.80900 -1.0 2.0
   49    52    54    55   0.41150 -1.0 2.0
   49    52    54    56   0.41150 -1.0 2.0
   49    52    57    58   0.17350  1.0 3.0
   49    52    57    59   0.17350  1.0 3.0
   49    52    57    60   0.17350  1.0 3.0
   50    49    52    53   0.15000  1.0 3.0
   50    49    52    54  -0.11250  1.0 3.0
   50    49    52    57   0.19200  1.0 3.0
   51    49    52    53   0.15000  1.0 3.0
   51    49    52    54  -0.11250  1.0 3.0
   51    49    52    57   0.19200  1.0 3.0
   53    52    54    55   0.00000  1.0 1.0
   53    52    54    56   0.00000  1.0 1.0
   53    52    57    58   0.13050  1.0 3.0
   53    52    57    59   0.13050  1.0 3.0
   53    52    57    60   0.13050  1.0 3.0
   54    52    57    58   0.17350  1.0 3.0
   54    52    57    59   0.17350  1.0 3.0
   54    52    57    60   0.17350  1.0 3.0
   57    52    54    55   0.30150 -1.0 2.0
   57    52    54    56   0.30150 -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
   36    30    35    37  10.50000 -1.0 2.0
   38    43    41    42  10.50000 -1.0 2.0
   44    41    43    45   1.00000 -1.0 2.0
   55    52    54    56  10.50000 -1.0 2.0
END
