* LIGAND DATABASE FILE (OPLS2005)
*
001      62    62    113    162     325
    1     0 S   NP   _N1_     1    28.85694    94.51749   -20.86930
    2     1 S   H    _HN1     2     1.02961    89.41673    23.72596
    3     1 S   H    _H1_     3     1.02837    32.73541   147.44668
    4     1 S   H    _H2_     4     1.02778    88.33275   -84.65546
    5     1 S   CT   _CA1     5     1.50140   143.45482   148.58095
    6     5 S   HC   _HA1     6     1.09570   105.20246    58.46391
    7     5 S   CO3  _C1_     7     1.53854   112.55251   -61.65562
    8     7 S   O2Z  _O11     8     1.26368   115.00107   -37.81098
    9     7 S   O2Z  _O12     9     1.26241   115.02682   141.52844
   10     5 S   CT   _CB1    10     1.53145   107.41267   176.48492
   11    10 S   HC   HB11    11     1.09815   109.48948   -49.21126
   12    10 S   HC   HB12    12     1.09826   110.30286    67.44887
   13    10 S   CT   _CG1    13     1.52941   112.63104  -170.30075
   14    13 S   HC   HG11    14     1.09505   110.13949   -63.64478
   15    13 S   HC   HG12    15     1.09636   110.11384    55.60951
   16    13 S   C    _CD1    16     1.51750   112.60758   176.44367
   17    16 S   O    _OE1    17     1.22695   123.30298    -1.27641
   18    16 S   N    _N2_    18     1.38674   111.49940   178.27955
   19    18 S   H    _HN2    19     1.01528   118.95980     3.18303
   20    18 S   CT1  _CA2    20     1.46320   123.47471  -176.39223
   21    20 S   HC   _HA2    21     1.09722   109.35099   -13.63365
   22    20 S   C    _C2_    22     1.53362   108.41805  -129.57522
   23    22 S   O    _O2_    23     1.23008   122.18144  -146.61281
   24    20 S   CT   _CB2    32     1.53546   111.20308   108.39046
   25    24 S   HC   HB21    33     1.09583   109.39895    56.72187
   26    24 S   HC   HB22    34     1.09494   110.86977   175.62485
   27    22 S   N    _N3_    24     1.38482   113.37580    40.64574
   28    27 S   H    _HN3    25     1.01535   118.90947    -0.48618
   29    24 S   S    _SG2    35     1.82553   111.40193   -64.33778
   30    27 S   CT   _CA3    26     1.45459   123.56053   175.29672
   31    30 S   HC   HA31    27     1.09513   109.38671    21.30118
   32    30 S   HC   HA32    28     1.09499   107.08336   138.33206
   33    29 S   CT   _C9_    36     1.82304    99.65969   160.53002
   34    33 S   HC   _H3_    37     1.09440   108.22541    83.80737
   35    33 S   HC   _H4_    38     1.09384   109.86994   -33.92677
   36    30 S   CO3  _C3_    29     1.52912   113.00566  -102.27850
   37    36 S   O2Z  _O31    30     1.26408   115.36053   -45.09607
   38    36 S   O2Z  _O32    31     1.26345   115.00330   135.80034
   39    33 S   CT   _C7_    39     1.52970   111.00128  -155.64909
   40    39 S   HC   _H20    40     1.09578   110.55477   -59.25696
   41    39 S   HC   _H21    41     1.09557   109.35480  -176.52070
   42    39 S   N    _N8_    42     1.46759   112.89731    64.98385
   43    42 S   C    _C4_    43     1.39505   119.82645  -112.05031
   44    43 S   O    _O10    44     1.23037   125.04747    -0.01978
   45    43 S   CT   _C5_    45     1.51231   114.24482   177.91531
   46    45 S   HC   _H16    46     1.09539   108.36617   171.97982
   47    45 S   HC   _H17    47     1.09397   108.34147   -71.06375
   48    45 S   CT   _C6_    48     1.51634   110.83075    51.73342
   49    48 S   HC   _H18    49     1.09517   110.78658    56.53541
   50    48 S   HC   _H19    50     1.09430   109.91420   175.68561
   51    48 S   OS   _O34    51     1.41967   112.78953   -64.23193
   52    42 S   P1   _P14    52     1.73646   120.32968    67.10583
   53    52 S   O2Z  _O33    53     1.50711   112.47856    25.94252
   54    52 S   NX   _N9_    54     1.65956   106.73905  -101.10385
   55    54 S   H    _H28    55     1.01826   114.61055    55.00836
   56    54 S   CT   _C8_    56     1.46246   118.15000  -174.32418
   57    56 S   HC   _H22    57     1.09589   109.13944   -61.31574
   58    56 S   HC   _H23    58     1.09568   109.33162    56.38369
   59    56 S   CT   _C10    59     1.52238   110.58884   177.44166
   60    59 S   Cl   CL15    60     1.77937   110.37533   179.12665
   61    59 S   HC   _H26    61     1.09450   111.39727    59.87771
   62    59 S   HC   _H27    62     1.09345   111.40694   -61.54916
  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
   8   5   4   2   1   1  10   4   3  12  11   5   7   5   4   6
   3   2   5   7   3   8   4   6   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    42  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    52  
   35    39    40    41    42  
   39    40    41    42  
   37    38  
   38  
    0  
   40    41    42    43    44    45    51    52    53    54  
   41    42    43    52  
   42    43    52  
   43    44    45    46    47    48    51    52    53    54    55    56  
   44    45    46    47    48    49    50    51    52    53    54  
   45    46    47    48    52  
   46    47    48    49    50    51    52  
   47    48    49    50    51  
   48    49    50    51  
   49    50    51    52    53    54  
   50    51    52  
   51    52  
   52    53    54    55    56  
   53    54    55    56    57    58    59  
   54    55    56  
   55    56    57    58    59    60    61    62  
   56    57    58    59  
   57    58    59    60    61    62  
   58    59    60    61    62  
   59    60    61    62  
   60    61    62  
   61    62  
   62  
    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   0.002500   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   42   3.2500   0.1700  -0.457500   1.8100   1.6000   0.054801302  -1.445846770
   43   3.7500   0.1050   0.622500   1.9250   1.7000   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   45   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660   0.152900   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.8500   0.1400  -0.461100   1.5900   1.4000   0.020110767  -0.896042159
   52   3.7400   0.2000   1.279300   2.1070   1.8700   0.005000000   0.000000000
   53   2.9800   0.2000  -0.666100   1.6890   1.4900   0.001000000  -0.126889456
   54   3.2500   0.1700  -0.566600   1.8100   1.6000   0.054801302  -1.445846770
   55   0.5000   0.0300   0.294300   0.9960   0.8600   0.030040813  -0.651083722
   56   3.5000   0.0660  -0.060200   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.006000   1.9750   1.7500   0.005000000  -0.741685710
   60   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   61   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.103000   1.4250   1.2500   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    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   340.000  1.090
   39    42   337.000  1.449
   42    43   490.000  1.335
   42    52   290.000  1.710
   43    44   570.000  1.229
   43    45   317.000  1.522
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   268.000  1.529
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   320.000  1.410
   51    52   405.000  1.623
   52    53   675.000  1.490
   52    54   305.000  1.702
   54    55   505.000  1.018
   54    56   310.000  1.452
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   268.000  1.529
   59    60   245.000  1.781
   59    61   340.000  1.090
   59    62   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    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    37.50000  110.70000
   33    39    42    70.00000  110.72300
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    42    43    50.00000  121.90000
   39    42    52    55.00000  124.56000
   41    39    40    33.00000  107.80000
   42    39    40    35.00000  109.50000
   42    39    41    35.00000  109.50000
   42    43    44    80.00000  122.90000
   42    43    45    70.00000  116.60000
   42    52    51   105.00000  101.75000
   42    52    53    85.00000  113.20000
   42    52    54    90.00000  101.80600
   43    45    46    35.00000  109.50000
   43    45    47    35.00000  109.50000
   43    45    48    63.00000  111.10000
   45    43    44    80.00000  120.40000
   45    48    49    37.50000  110.70000
   45    48    50    37.50000  110.70000
   45    48    51    50.00000  109.50000
   47    45    46    33.00000  107.80000
   48    45    46    37.50000  110.70000
   48    45    47    37.50000  110.70000
   48    51    52    75.00000  119.24600
   50    48    49    33.00000  107.80000
   51    48    49    35.00000  109.50000
   51    48    50    35.00000  109.50000
   51    52    53   100.00000  115.86100
   51    52    54   105.00000  102.60700
   52    42    43    55.00000  124.94500
   52    54    55    40.00000  115.80200
   52    54    56    60.00000  116.07500
   54    52    53    85.00000  116.90400
   54    56    57    50.00000  110.67200
   54    56    58    50.00000  110.67200
   54    56    59    75.00000  110.98300
   56    54    55    50.00000  108.89700
   56    59    60    69.00000  109.80000
   56    59    61    37.50000  110.70000
   56    59    62    37.50000  110.70000
   58    56    57    33.00000  107.80000
   59    56    57    37.50000  110.70000
   59    56    58    37.50000  110.70000
   61    59    60    51.00000  107.60000
   62    59    60    51.00000  107.60000
   62    59    61    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    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   0.15000  1.0 3.0
   29    33    39    42   0.56750  1.0 1.0
   29    33    39    42  -0.07550 -1.0 2.0
   29    33    39    42   0.20000  1.0 3.0
   33    39    42    43  -0.43950  1.0 1.0
   33    39    42    43  -0.08100 -1.0 2.0
   33    39    42    43   0.03350  1.0 3.0
   33    39    42    52   0.17850 -1.0 2.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    42   0.15000  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    42   0.15000  1.0 3.0
   39    42    43    44   3.04450 -1.0 2.0
   39    42    43    45   1.49850  1.0 1.0
   39    42    43    45   1.53950 -1.0 2.0
   39    42    52    51   0.00000  1.0 1.0
   39    42    52    53   0.00000  1.0 1.0
   39    42    52    54   0.00000  1.0 1.0
   40    39    42    43   0.00000  1.0 1.0
   40    39    42    52   0.00000  1.0 1.0
   41    39    42    43   0.00000  1.0 1.0
   41    39    42    52   0.00000  1.0 1.0
   42    43    45    46   0.00000  1.0 1.0
   42    43    45    47   0.00000  1.0 1.0
   42    43    45    48   1.39750  1.0 1.0
   42    43    45    48  -0.07950 -1.0 2.0
   42    43    45    48  -0.18750  1.0 3.0
   42    52    54    55   0.25000  1.0 3.0
   42    52    54    56   0.25000  1.0 3.0
   43    42    52    51   0.00000  1.0 1.0
   43    42    52    53   0.00000  1.0 1.0
   43    42    52    54   0.00000  1.0 1.0
   43    45    48    49  -0.11250  1.0 3.0
   43    45    48    50  -0.11250  1.0 3.0
   43    45   -48    51  -0.09450  1.0 1.0
   43    45   -48    51  -1.12950 -1.0 2.0
   43    45   -48    51   0.54000  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   0.30150 -1.0 2.0
   45    48    51    52  -2.65550  1.0 1.0
   45    48    51    52  -0.22350 -1.0 2.0
   45    48    51    52   0.24150  1.0 3.0
   46    45    48    49   0.15000  1.0 3.0
   46    45    48    50   0.15000  1.0 3.0
   46    45    48    51   0.23400  1.0 3.0
   47    45    48    49   0.15000  1.0 3.0
   47    45    48    50   0.15000  1.0 3.0
   47    45    48    51   0.23400  1.0 3.0
   48    51   -52    42   0.15000  1.0 3.0
   48    51    52    53   0.00000  1.0 1.0
   48    51    52    54  -0.14600  1.0 1.0
   48    51    52    54  -0.87400 -1.0 2.0
   48    51    52    54   0.68500  1.0 3.0
   49    48    51    52   0.03000  1.0 3.0
   50    48    51    52   0.03000  1.0 3.0
   51    52    54    55   0.07350  1.0 1.0
   51    52    54    55  -1.26400 -1.0 2.0
   51    52    54    55   0.45050  1.0 3.0
   51    52    54    56   0.29300  1.0 1.0
   51    52    54    56  -1.33650 -1.0 2.0
   51    52    54    56   0.62200  1.0 3.0
   52    42    43    44   2.45000 -1.0 2.0
   52    42   -43    45   2.45000 -1.0 2.0
   52    54    56    57   0.05900  1.0 3.0
   52    54    56    58   0.05900  1.0 3.0
   52    54    56    59  -2.23400  1.0 1.0
   52    54    56    59  -0.50500 -1.0 2.0
   52    54    56    59   0.66300  1.0 3.0
   53    52    54    55   0.00000  1.0 1.0
   53    52    54    56   0.00000  1.0 1.0
   54    56    59    60   0.56750  1.0 1.0
   54    56    59    60  -0.07550 -1.0 2.0
   54    56    59    60   0.20000  1.0 3.0
   54    56    59    61   0.15000  1.0 3.0
   54    56    59    62   0.15000  1.0 3.0
   55    54    56    57   0.20000  1.0 3.0
   55    54    56    58   0.20000  1.0 3.0
   55    54    56    59   0.14900  1.0 1.0
   55    54    56    59  -0.14450 -1.0 2.0
   55    54    56    59  -0.19400  1.0 3.0
   57    56    59    60   0.27000  1.0 3.0
   57    56    59    61   0.15000  1.0 3.0
   57    56    59    62   0.15000  1.0 3.0
   58    56    59    60   0.27000  1.0 3.0
   58    56    59    61   0.15000  1.0 3.0
   58    56    59    62   0.15000  1.0 3.0
IPHI
    9     5     7     8  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
   38    30    36    37  10.50000 -1.0 2.0
   43    52    42    39   1.00000 -1.0 2.0
   42    45    43    44  10.50000 -1.0 2.0
   55    52    54    56   1.00000 -1.0 2.0
END
