* LIGAND DATABASE FILE (OPLS2005)
*
001      61    62    118    189     344
    1     0 S   NP   _N1_     1    28.58660    94.86618   -22.50778
    2     1 S   H    _HN1     2     1.02960    84.13849    24.83620
    3     1 S   H    _H1_     3     1.02836    29.33410   166.46893
    4     1 S   H    _H2_     4     1.02778    99.00509   -82.84920
    5     1 S   CT   _CA1     5     1.50119   137.81429   138.92803
    6     5 S   HC   _HA1     6     1.09576   105.22567    73.16201
    7     5 S   CO3  _C1_     7     1.53778   112.40374   -47.03467
    8     7 S   O2Z  _O11     8     1.26358   115.00190   -43.64766
    9     7 S   O2Z  _O12     9     1.26240   114.91893   135.53010
   10     5 S   CT   _CB1    10     1.53095   107.42798  -168.94078
   11    10 S   HC   HB11    11     1.09826   109.30030   -50.93202
   12    10 S   HC   HB12    12     1.09818   110.42641    65.60670
   13    10 S   CT   _CG1    13     1.53015   112.69117  -172.04024
   14    13 S   HC   HG11    14     1.09595   110.45584   -64.42267
   15    13 S   HC   HG12    15     1.09656   109.96203    54.79952
   16    13 S   C    _CD1    16     1.51824   112.32591   175.13156
   17    16 S   O    _OE1    17     1.22722   123.26647    -1.09789
   18    16 S   N    _N2_    18     1.38647   111.65150   179.12174
   19    18 S   H    _HN2    19     1.01584   119.01416     1.11663
   20    18 S   CT1  _CA2    20     1.46158   123.35936   179.28454
   21    20 S   HC   _HA2    21     1.09739   109.38836    -5.89319
   22    20 S   C    _C2_    22     1.53477   108.46612  -121.43865
   23    22 S   O    _O2_    23     1.23031   122.16413  -145.84019
   24    20 S   CT   _CB2    32     1.53376   111.67553   116.10010
   25    24 S   HC   HB21    33     1.09597   110.13611    55.71739
   26    24 S   HC   HB22    34     1.09444   110.03791   174.55597
   27    22 S   N    _N3_    24     1.38483   113.48886    41.54965
   28    27 S   H    _HN3    25     1.01507   118.96784    -0.62776
   29    24 S   S    _SG2    35     1.82871   111.82898   -65.01981
   30    27 S   CT   _CA3    26     1.45453   123.46676   174.97270
   31    30 S   HC   HA31    27     1.09520   109.28621    23.87808
   32    30 S   HC   HA32    28     1.09496   107.12485   140.90174
   33    29 S   CT   _C10    36     1.83289    99.42031  -177.32065
   34    33 S   HC   _H6_    37     1.09930   104.20511   -43.09018
   35    30 S   CO3  _C3_    29     1.52920   113.01902   -99.61618
   36    35 S   O2Z  _O31    30     1.26408   115.36267   -45.40331
   37    35 S   O2Z  _O32    31     1.26347   115.00703   135.47917
   38    33 S   CT   _C11    38     1.54966   109.13511  -154.10921
   39    38 S   HC   _H12    39     1.09820   108.70375    79.47840
   40    38 S   HC   _H13    40     1.09584   112.55292   -37.48997
   41    38 S   C4T  _C6_    41     1.53712   110.96210  -160.80189
   42    41 S   HC   _H3_    42     1.09515   111.95470  -162.79590
   43    41 S   C4T  _C7_    43     1.55892   111.83619   -31.70500
   44    43 S   HC   _H10    44     1.09506   115.37630  -162.35727
   45    43 S   HC   _H11    45     1.09431   117.19945   -36.13001
   46    41 S   C4T  _C5_    53     1.57850   114.30071    64.69015
   47    43 S   C4T  _C8_    46     1.56370    84.66002    81.94133
   48    47 S   HC   _H4_    47     1.09638   114.07964   147.87846
   49    46 S   CT   _C4_    54     1.54254   115.10830   166.18401
   50    49 S   HC   _H7_    55     1.09585   110.37108   168.56782
   51    49 S   HC   _H8_    56     1.09265   113.68237    48.36270
   52    49 S   HC   _H9_    57     1.09582   110.49409   -72.07652
   53    46 S   CT   _C13    58     1.53171   116.08210    39.66542
   54    53 S   HC   _H15    59     1.09551   110.79944  -172.58434
   55    53 S   HC   _H16    60     1.09600   110.47102    68.31398
   56    53 S   HC   _H17    61     1.09164   113.59294   -51.85360
   57    33 S   CT   _C9_    48     1.56273   117.56403    73.26085
   58    57 S   HC   _H5_    49     1.10044   106.10998   -91.02504
   59    57 S   CO4  _C12    50     1.52178   117.25387    23.39671
   60    59 S   O    _O33    51     1.22829   124.08933   138.66374
   61    59 S   HC   _H14    52     1.10104   116.49503   -47.42347
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  15   8   2   1   1  14   6   5  16   7  10   5   4  13  14   5
   8   3   2   1   4   2   1   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    57    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    47    57    58    59  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    47    48    57    58    59    60    61    46  
   38    39    40    41    47    57    58    59  
   36    37  
   37  
    0  
   39    40    41    42    43    44    45    47    57    58    59    46    49    53  
   40    41    42    43    57    46  
   41    42    43    57    46  
   42    43    44    45    47    48    57    46    49    50    51    52    53    54    55    56  
   43    44    45    47    46    49    53  
   44    45    47    48    57    58    59    46    49    53  
   45    47    48    57    46  
   47    48    57    46  
   49    50    51    52    53    54    55    56    47    48    57    58    59  
   48    57    58    59    60    61    49    50    51    52    53    54    55    56  
   57    58    59    49    53  
   50    51    52    53    54    55    56    57  
   51    52    53  
   52    53  
   53  
   54    55    56    57  
   55    56  
   56  
    0  
   58    59    60    61  
   59    60    61  
   60    61  
   61  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5000   0.0660  -0.061200   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660  -0.118800   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660  -0.117600   1.9750   1.7500   0.005000000  -0.741685710
   47   3.5000   0.0660  -0.118800   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.121200   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.121200   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660  -0.001200   1.9750   1.7500   0.005000000  -0.741685710
   58   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   59   3.7500   0.1050   0.450000   2.1120   1.8750   0.001000000  -0.126889456
   60   2.9600   0.2100  -0.450000   1.6780   1.4800   0.001000000  -0.126889456
   61   2.4200   0.0150   0.000000   1.3810   1.2100   0.008598240   0.268726247
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    57   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   260.000  1.519
   41    42   340.000  1.090
   41    43   268.000  1.529
   41    46   268.000  1.529
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    47   268.000  1.529
   47    48   340.000  1.090
   47    57   260.000  1.519
   47    46   268.000  1.529
   57    58   340.000  1.090
   57    59   317.000  1.522
   59    60   570.000  1.229
   59    61   340.000  1.090
   46    49   260.000  1.519
   46    53   260.000  1.519
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   340.000  1.090
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    57    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    70.00000  112.98000
   33    57    47    70.00000  112.98000
   33    57    58    37.50000  110.70000
   33    57    59    63.00000  111.10000
   38    33    34    37.50000  110.70000
   38    41    42    45.00000  112.72800
   38    41    43    65.00000  119.52000
   38    41    46    65.00000  119.52000
   40    38    39    33.00000  107.80000
   41    38    39    45.00000  111.22300
   41    38    40    45.00000  111.22300
   41    43    44    37.50000  110.70000
   41    43    45    37.50000  110.70000
   41    43    47    63.00000   92.00000
   41    46    47    63.00000   92.00000
   41    46    49    65.00000  119.52000
   41    46    53    65.00000  119.52000
   43    41    42    37.50000  110.70000
   43    47    48    37.50000  110.70000
   43    47    57    65.00000  119.52000
   43    47    46    63.00000   92.00000
   45    43    44    33.00000  107.80000
   47    43    44    37.50000  110.70000
   47    43    45    37.50000  110.70000
   47    57    58    45.00000  111.22300
   47    57    59    63.00000  111.10000
   47    46    49    65.00000  119.52000
   47    46    53    65.00000  119.52000
   57    33    34    37.50000  110.70000
   57    33    38    58.35000  112.70000
   57    47    48    45.00000  112.72800
   57    59    60    80.00000  120.40000
   57    59    61    35.00000  115.00000
   59    57    58    35.00000  109.50000
   61    59    60    35.00000  123.00000
   46    41    42    37.50000  110.70000
   46    41    43    63.00000   92.00000
   46    47    48    37.50000  110.70000
   46    47    57    65.00000  119.52000
   46    49    50    45.00000  111.22300
   46    49    51    45.00000  111.22300
   46    49    52    45.00000  111.22300
   46    53    54    45.00000  111.22300
   46    53    55    45.00000  111.22300
   46    53    56    45.00000  111.22300
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    33.00000  107.80000
   53    46    49    58.35000  112.70000
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    57   0.01700  1.0 1.0
   24    29    33    57  -0.23550 -1.0 2.0
   24    29    33    57   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.44750  1.0 1.0
   29    33    38    41  -0.17800 -1.0 2.0
   29    33    38    41   0.20200  1.0 3.0
   29    33    57    47   0.44750  1.0 1.0
   29    33    57    47  -0.17800 -1.0 2.0
   29    33    57    47   0.20200  1.0 3.0
   29    33    57    58   0.15000  1.0 3.0
   29    33    57    59   0.56750  1.0 1.0
   29    33    57    59  -0.07550 -1.0 2.0
   29    33    57    59   0.20000  1.0 3.0
   33    38    41    42   0.15000  1.0 3.0
   33    38    41    43   0.04050  1.0 1.0
   33    38    41    43   0.63700 -1.0 2.0
   33    38    41    43   0.17650  1.0 3.0
   33    38    41    46   0.04050  1.0 1.0
   33    38    41    46   0.63700 -1.0 2.0
   33    38    41    46   0.17650  1.0 3.0
   33    57    59    60   0.30150 -1.0 2.0
   33    57    59    61   0.74550  1.0 1.0
   33    57    59    61  -0.00500 -1.0 2.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    41   0.15000  1.0 3.0
   34    33    57    47   0.15000  1.0 3.0
   34    33    57    58   0.15000  1.0 3.0
   34    33    57    59  -0.11250  1.0 3.0
   38    33    57    47   0.31550 -1.0 2.0
   38    33    57    47   0.11250  1.0 3.0
   38    33    57    58   0.15000  1.0 3.0
   38    33    57    59  -0.95700  1.0 1.0
   38    33    57    59  -0.18200 -1.0 2.0
   38    33    57    59   0.29450  1.0 3.0
   38    41    43    44   0.15000  1.0 3.0
   38    41    43    45   0.15000  1.0 3.0
   38    41   -43    47  -0.70950  1.0 1.0
   38    41   -43    47   0.38400 -1.0 2.0
   38    41   -46    47  -0.70950  1.0 1.0
   38    41   -46    47   0.38400 -1.0 2.0
   38    41    46    49   0.56750  1.0 1.0
   38    41    46    49  -0.07550 -1.0 2.0
   38    41    46    49   0.20000  1.0 3.0
   38    41    46    53   0.56750  1.0 1.0
   38    41    46    53  -0.07550 -1.0 2.0
   38    41    46    53   0.20000  1.0 3.0
   39    38    41    42   0.15000  1.0 3.0
   39    38    41    43   0.00000  1.0 1.0
   39    38    41    46   0.00000  1.0 1.0
   40    38    41    42   0.15000  1.0 3.0
   40    38    41    43   0.00000  1.0 1.0
   40    38    41    46   0.00000  1.0 1.0
   41    43    47    48   0.15000  1.0 3.0
   41    43    47    57  -0.70950  1.0 1.0
   41    43    47    57   0.38400 -1.0 2.0
   41    43   -47    46   0.00000  1.0 1.0
   41    46    49    50   0.00000  1.0 1.0
   41    46    49    51   0.00000  1.0 1.0
   41    46    49    52   0.00000  1.0 1.0
   41    46    53    54   0.00000  1.0 1.0
   41    46    53    55   0.00000  1.0 1.0
   41    46    53    56   0.00000  1.0 1.0
   42    41    43    44   0.15000  1.0 3.0
   42    41    43    45   0.15000  1.0 3.0
   42    41    43    47   0.15000  1.0 3.0
   42    41   -46    47   0.15000  1.0 3.0
   42    41    46    49   0.15000  1.0 3.0
   42    41    46    53   0.15000  1.0 3.0
   43    41   -46    47   0.00000  1.0 1.0
   43    41    46    49  -0.70950  1.0 1.0
   43    41    46    49   0.38400 -1.0 2.0
   43    41    46    53  -0.70950  1.0 1.0
   43    41    46    53   0.38400 -1.0 2.0
   43    47   -57    33   0.04050  1.0 1.0
   43    47   -57    33   0.63700 -1.0 2.0
   43    47   -57    33   0.17650  1.0 3.0
   43    47    57    58   0.00000  1.0 1.0
   43    47    57    59  -0.95700  1.0 1.0
   43    47    57    59  -0.18200 -1.0 2.0
   43    47    57    59   0.29450  1.0 3.0
   43    47   -46    41   0.00000  1.0 1.0
   43    47   -46    49  -0.70950  1.0 1.0
   43    47   -46    49   0.38400 -1.0 2.0
   43    47   -46    53  -0.70950  1.0 1.0
   43    47   -46    53   0.38400 -1.0 2.0
   44    43    47    48   0.15000  1.0 3.0
   44    43    47    57   0.15000  1.0 3.0
   44    43    47    46   0.15000  1.0 3.0
   45    43    47    48   0.15000  1.0 3.0
   45    43    47    57   0.15000  1.0 3.0
   45    43    47    46   0.15000  1.0 3.0
   47    57    59    60   0.30150 -1.0 2.0
   47    57    59    61   0.74550  1.0 1.0
   47    57    59    61  -0.00500 -1.0 2.0
   47    46    49    50   0.00000  1.0 1.0
   47    46    49    51   0.00000  1.0 1.0
   47    46    49    52   0.00000  1.0 1.0
   47    46    53    54   0.00000  1.0 1.0
   47    46    53    55   0.00000  1.0 1.0
   47    46    53    56   0.00000  1.0 1.0
   48    47    57    33   0.15000  1.0 3.0
   48    47    57    58   0.15000  1.0 3.0
   48    47    57    59  -0.11250  1.0 3.0
   48    47   -46    41   0.15000  1.0 3.0
   48    47    46    49   0.15000  1.0 3.0
   48    47    46    53   0.15000  1.0 3.0
   57    33    38    39   0.15000  1.0 3.0
   57    33    38    40   0.15000  1.0 3.0
   57    33   -38    41   0.31550 -1.0 2.0
   57    33   -38    41   0.11250  1.0 3.0
   57    47   -46    41  -0.70950  1.0 1.0
   57    47   -46    41   0.38400 -1.0 2.0
   57    47    46    49   0.56750  1.0 1.0
   57    47    46    49  -0.07550 -1.0 2.0
   57    47    46    49   0.20000  1.0 3.0
   57    47    46    53   0.56750  1.0 1.0
   57    47    46    53  -0.07550 -1.0 2.0
   57    47    46    53   0.20000  1.0 3.0
   58    57    59    60   0.00000  1.0 1.0
   58    57    59    61   0.00000  1.0 1.0
   46    41   -43    44   0.15000  1.0 3.0
   46    41   -43    45   0.15000  1.0 3.0
   46    41   -43    47   0.00000  1.0 1.0
   46    47   -57    33   0.04050  1.0 1.0
   46    47   -57    33   0.63700 -1.0 2.0
   46    47   -57    33   0.17650  1.0 3.0
   46    47    57    58   0.00000  1.0 1.0
   46    47    57    59  -0.95700  1.0 1.0
   46    47    57    59  -0.18200 -1.0 2.0
   46    47    57    59   0.29450  1.0 3.0
   49    46    53    54   0.15000  1.0 3.0
   49    46    53    55   0.15000  1.0 3.0
   49    46    53    56   0.15000  1.0 3.0
   53    46    49    50   0.15000  1.0 3.0
   53    46    49    51   0.15000  1.0 3.0
   53    46    49    52   0.15000  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   57    61    59    60  10.50000 -1.0 2.0
END
