* LIGAND DATABASE FILE (OPLS2005)
*
001      63    64    121    188     360
    1     0 S   NP   _N1_     1    29.10618    94.71501   -18.92813
    2     1 S   H    _HN1     2     1.02792    71.12483   -85.56757
    3     1 S   H    _H1_     3     1.02951    98.28018    20.99431
    4     1 S   H    _H2_     4     1.02850    42.95555   127.20275
    5     1 S   CT   _CA1     5     1.50057   147.11684   172.52168
    6     5 S   HC   _HA1     6     1.09552   105.38494    28.19724
    7     5 S   CO3  _C1_     7     1.53965   112.24385   -92.50468
    8     7 S   O2Z  _O11     8     1.26390   115.08064   -46.49419
    9     7 S   O2Z  _O12     9     1.26209   115.02289   132.98509
   10     5 S   CT   _CB1    10     1.53123   107.51864   146.51355
   11    10 S   HC   HB11    11     1.09814   109.98367   -47.06691
   12    10 S   HC   HB12    12     1.09809   110.07466    69.53520
   13    10 S   CT   _CG1    13     1.53061   112.49159  -168.00860
   14    13 S   HC   HG11    14     1.09491   110.54012   -50.02935
   15    13 S   HC   HG12    15     1.09602   110.17492    68.90671
   16    13 S   C    _CD1    16     1.51764   111.88428  -170.71638
   17    16 S   O    _OE1    17     1.22735   123.04142   -17.67295
   18    16 S   N    _N2_    18     1.38565   111.80058   162.61783
   19    18 S   H    _HN2    19     1.01583   119.10444     2.93044
   20    18 S   CT1  _CA2    20     1.46255   123.41121  -175.40927
   21    20 S   HC   _HA2    21     1.09725   109.42719   -14.68687
   22    20 S   C    _C2_    22     1.53339   108.31041  -130.59854
   23    22 S   O    _O2_    23     1.23002   122.28908  -144.95395
   24    20 S   CT   _CB2    32     1.53509   111.03544   107.33147
   25    24 S   HC   HB21    33     1.09418   109.54884    56.13510
   26    24 S   HC   HB22    34     1.09516   110.68633   174.36765
   27    22 S   N    _N3_    24     1.38522   113.30054    42.35171
   28    27 S   H    _HN3    25     1.01531   118.92911    -0.43386
   29    24 S   S    _SG2    35     1.82873   111.57452   -66.47679
   30    27 S   CT   _CA3    26     1.45448   123.38321   175.13764
   31    30 S   HC   HA31    27     1.09527   109.16291    25.71814
   32    30 S   HC   HA32    28     1.09493   107.13648   142.71375
   33    29 S   CT   _C13    36     1.83591   100.57959   148.75280
   34    33 S   HC   _H5_    37     1.09453   104.68368    39.44785
   35    30 S   CO3  _C3_    29     1.52933   113.18297   -97.70606
   36    35 S   O2Z  _O31    30     1.26396   115.43763   -43.63940
   37    35 S   O2Z  _O32    31     1.26360   114.96001   137.30671
   38    33 S   CM   _C6_    38     1.53643   110.27517   155.43912
   39    33 S   CT   _C12    52     1.53902   113.82964   -73.21649
   40    39 S   HC   _H17    53     1.09865   108.40828   179.49487
   41    39 S   HC   _H18    54     1.09801   108.91795    67.09397
   42    38 S   CT   _C7_    39     1.53304   119.26002    83.82765
   43    42 S   HC   _H3_    40     1.09535   110.73231   167.66001
   44    38 S   CMA  _C5_    58     1.36850   122.30003   -98.51329
   45    44 S   OM   _O33    59     1.26385   130.14511  -177.71022
   46    42 S   CT   _C8_    41     1.52616   115.71599   -68.76001
   47    46 S   HC   _H9_    42     1.09399   113.72560   -26.45606
   48    46 S   HC   _H10    43     1.09809   109.28160  -144.73790
   49    44 S   CT   _C4_    60     1.52445   120.31390     3.28360
   50    49 S   HC   _H6_    61     1.09597   111.45623    46.83317
   51    49 S   HC   _H7_    62     1.09670   110.36947   -74.53871
   52    49 S   HC   _H8_    63     1.09924   113.46692   165.41136
   53    46 S   CT   _C9_    44     1.52383   106.30065    98.11696
   54    53 S   HC   _H11    45     1.09700   109.17218   127.41118
   55    53 S   HC   _H12    46     1.09359   112.10046  -115.55538
   56    53 S   CT   _C10    47     1.52743   106.78810     8.54036
   57    56 S   HC   _H4_    48     1.09575   110.29435   128.86384
   58    56 S   CT   _C11    49     1.52812   114.62627  -106.97934
   59    58 S   HC   _H15    50     1.09544   109.89223   -34.46486
   60    58 S   HC   _H16    51     1.09912   107.29148  -147.55357
   61    42 S   NP   _N4_    55     1.50250   114.93321    50.31792
   62    61 S   H    _H13    56     1.02811   112.44464    37.44533
   63    61 S   H    _H14    57     1.02938   108.66347   153.96254
  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
  16   7   2   1   1  20  11   5   4  16   9   7   4  11   6   5
   3   2   1   1  10   5   4   7   6   5   2   1   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    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    42    58    39    40    41    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    42    43    46    56    58    59    60    39    40    41    61    44    45    49  
   38    42    58    39    40    41    44  
   36    37  
   37  
    0  
   42    43    46    47    48    53    56    58    39    40    41    61    62    63    44    45    49    50    51    52  
   40    41    61    44    42    53    56    57    58    59    60  
   41    56    58    59    60  
   56    58    59    60  
   43    46    47    48    53    54    55    56    57    58    61    62    63    44    45    49  
   46    47    48    53    56    61    62    63    44  
   45    49    50    51    52    46    61  
   49    50    51    52  
   47    48    53    54    55    56    57    58    61    62    63  
   48    53    54    55    56    61  
   53    54    55    56    61  
   50    51    52  
   51    52  
   52  
    0  
   54    55    56    57    58    59    60    61    62    63  
   55    56    57    58    61  
   56    57    58    61  
   57    58    59    60    61    62    63  
   58    59    60    61    62    63  
   59    60    61    62    63  
   60    61  
   61  
   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   0.107500   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   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   42   3.5000   0.0660   0.230000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   44   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   45   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   46   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.180000   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   56   3.5000   0.0660   0.230000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   61   3.2500   0.1700  -0.200000   2.1950   1.9500   0.003973653   1.685851020
   62   0.5000   0.0300   0.310000   0.9960   0.8600   0.030040813  -0.651083722
   63   0.5000   0.0300   0.310000   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   317.000  1.510
   33    39   268.000  1.529
   38    42   317.000  1.510
   38    44   465.000  1.376
   42    43   340.000  1.090
   42    46   268.000  1.529
   42    61   367.000  1.471
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    53   268.000  1.529
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   268.000  1.529
   56    57   340.000  1.090
   56    58   268.000  1.529
   56    61   367.000  1.471
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    39   268.000  1.529
   39    40   340.000  1.090
   39    41   340.000  1.090
   61    62   434.000  1.010
   61    63   434.000  1.010
   44    45   745.000  1.250
   44    49   270.000  1.512
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   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  112.20000
   29    33    39    75.00000  111.63000
   33    38    42    65.00000  117.92700
   33    38    44    70.00000  124.00000
   33    39    58    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   38    33    34    35.00000  109.50000
   38    42    43    35.00000  109.50000
   38    42    46    70.00000  112.02700
   38    42    61    75.00000  110.06800
   38    44    45    65.00000  137.10300
   38    44    49    65.00000  122.18000
   42    46    47    37.50000  110.70000
   42    46    48    37.50000  110.70000
   42    46    53    58.35000  112.70000
   42    61    56    75.00000  113.01200
   42    61    62    35.00000  109.50000
   42    61    63    35.00000  109.50000
   46    42    43    37.50000  110.70000
   46    53    54    37.50000  110.70000
   46    53    55    37.50000  110.70000
   46    53    56    58.35000  112.70000
   48    46    47    33.00000  107.80000
   53    46    47    37.50000  110.70000
   53    46    48    37.50000  110.70000
   53    56    57    37.50000  110.70000
   53    56    58    58.35000  112.70000
   53    56    61    80.00000  111.20000
   55    53    54    33.00000  107.80000
   56    53    54    37.50000  110.70000
   56    53    55    37.50000  110.70000
   56    58    59    37.50000  110.70000
   56    58    60    37.50000  110.70000
   56    58    39    58.35000  112.70000
   56    61    62    35.00000  109.50000
   56    61    63    35.00000  109.50000
   58    56    57    37.50000  110.70000
   58    39    40    37.50000  110.70000
   58    39    41    37.50000  110.70000
   60    58    59    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.02700
   39    58    59    37.50000  110.70000
   39    58    60    37.50000  110.70000
   41    39    40    33.00000  107.80000
   61    42    43    35.00000  109.50000
   61    42    46    80.00000  111.20000
   61    56    57    35.00000  109.50000
   61    56    58    80.00000  111.20000
   63    61    62    35.00000  109.50000
   44    38    42    70.00000  124.00000
   44    49    50    45.00000  110.52000
   44    49    51    45.00000  110.52000
   44    49    52    45.00000  110.52000
   49    44    45    85.00000  112.85300
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    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  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  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    38    42   0.30250  1.0 1.0
   29    33    38    42  -0.14950 -1.0 2.0
   29    33    38    42   0.36900  1.0 3.0
   29    33    38    44   0.42700  1.0 1.0
   29    33    38    44  -0.70350 -1.0 2.0
   29    33    38    44  -0.43150  1.0 3.0
   29    33    39    58   0.44750  1.0 1.0
   29    33    39    58  -0.17800 -1.0 2.0
   29    33    39    58   0.20200  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   33    38    42    43   0.34800  1.0 3.0
   33    38    42    46   0.46850  1.0 1.0
   33    38    42    46   0.08550 -1.0 2.0
   33    38    42    46   0.09800  1.0 3.0
   33    38    42    61   0.52100  1.0 1.0
   33    38    42    61  -0.20350 -1.0 2.0
   33    38    42    61   0.29750  1.0 3.0
   33    38    44    45   7.00000 -1.0 2.0
   33    38    44    49   7.00000 -1.0 2.0
   34    33    38    42   0.34800  1.0 3.0
   34    33    38    44   0.00000  1.0 1.0
   34    33    39    58   0.15000  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   38    33    39    58   0.34400  1.0 1.0
   38    33    39    58   0.09450 -1.0 2.0
   38    33    39    58   0.11100  1.0 3.0
   38    33    39    40   0.15000  1.0 3.0
   38    33    39    41   0.15000  1.0 3.0
   38    42    46    47   0.15000  1.0 3.0
   38    42    46    48   0.15000  1.0 3.0
   38    42    46    53   0.34400  1.0 1.0
   38    42    46    53   0.09450 -1.0 2.0
   38    42    46    53   0.11100  1.0 3.0
   38    42    61    56   0.08000 -1.0 2.0
   38    42    61    62   0.17350  1.0 3.0
   38    42    61    63   0.17350  1.0 3.0
   38    44    49    50   0.00000  1.0 1.0
   38    44    49    51   0.00000  1.0 1.0
   38    44    49    52   0.00000  1.0 1.0
   42    38    44    45   7.00000 -1.0 2.0
   42    38    44    49   7.00000 -1.0 2.0
   42    46    53    54   0.15000  1.0 3.0
   42    46    53    55   0.15000  1.0 3.0
   42    46   -53    56   0.56750  1.0 1.0
   42    46   -53    56  -0.07550 -1.0 2.0
   42    46   -53    56   0.20000  1.0 3.0
   43    42    46    47   0.15000  1.0 3.0
   43    42    46    48   0.15000  1.0 3.0
   43    42    46    53   0.15000  1.0 3.0
   43    42    61    56   0.15000  1.0 3.0
   43    42    61    62   0.13050  1.0 3.0
   43    42    61    63   0.13050  1.0 3.0
   46    42   -61    56   0.47100  1.0 1.0
   46    42    61    62   0.17350  1.0 3.0
   46    42    61    63   0.17350  1.0 3.0
   46    53    56    57   0.15000  1.0 3.0
   46    53    56    58   0.56750  1.0 1.0
   46    53    56    58  -0.07550 -1.0 2.0
   46    53    56    58   0.20000  1.0 3.0
   46    53   -56    61   1.36600  1.0 1.0
   46    53   -56    61  -0.11450 -1.0 2.0
   46    53   -56    61   0.24250  1.0 3.0
   47    46    53    54   0.15000  1.0 3.0
   47    46    53    55   0.15000  1.0 3.0
   47    46    53    56   0.15000  1.0 3.0
   48    46    53    54   0.15000  1.0 3.0
   48    46    53    55   0.15000  1.0 3.0
   48    46    53    56   0.15000  1.0 3.0
   53    56    58    59   0.15000  1.0 3.0
   53    56    58    60   0.15000  1.0 3.0
   53    56    58    39   0.56750  1.0 1.0
   53    56    58    39  -0.07550 -1.0 2.0
   53    56    58    39   0.20000  1.0 3.0
   53    56   -61    42   0.47100  1.0 1.0
   53    56    61    62   0.17350  1.0 3.0
   53    56    61    63   0.17350  1.0 3.0
   54    53    56    57   0.15000  1.0 3.0
   54    53    56    58   0.15000  1.0 3.0
   54    53    56    61   0.19200  1.0 3.0
   55    53    56    57   0.15000  1.0 3.0
   55    53    56    58   0.15000  1.0 3.0
   55    53    56    61   0.19200  1.0 3.0
   56    58    39    33   0.56750  1.0 1.0
   56    58    39    33  -0.07550 -1.0 2.0
   56    58    39    33   0.20000  1.0 3.0
   56    58    39    40   0.15000  1.0 3.0
   56    58    39    41   0.15000  1.0 3.0
   57    56    58    59   0.15000  1.0 3.0
   57    56    58    60   0.15000  1.0 3.0
   57    56    58    39   0.15000  1.0 3.0
   57    56    61    42   0.15000  1.0 3.0
   57    56    61    62   0.13050  1.0 3.0
   57    56    61    63   0.13050  1.0 3.0
   58    56    61    42   0.47100  1.0 1.0
   58    56    61    62   0.17350  1.0 3.0
   58    56    61    63   0.17350  1.0 3.0
   59    58    39    33   0.15000  1.0 3.0
   59    58    39    40   0.15000  1.0 3.0
   59    58    39    41   0.15000  1.0 3.0
   60    58    39    33   0.15000  1.0 3.0
   60    58    39    40   0.15000  1.0 3.0
   60    58    39    41   0.15000  1.0 3.0
   39    33    38    42   0.46850  1.0 1.0
   39    33    38    42   0.08550 -1.0 2.0
   39    33    38    42   0.09800  1.0 3.0
   39    33    38    44   0.09850  1.0 1.0
   39    33    38    44   0.15250 -1.0 2.0
   39    33    38    44  -0.50650  1.0 3.0
   61    42    46    47   0.19200  1.0 3.0
   61    42    46    48   0.19200  1.0 3.0
   61    42   -46    53   1.36600  1.0 1.0
   61    42   -46    53  -0.11450 -1.0 2.0
   61    42   -46    53   0.24250  1.0 3.0
   61    56    58    59   0.19200  1.0 3.0
   61    56    58    60   0.19200  1.0 3.0
   61    56    58    39   1.36600  1.0 1.0
   61    56    58    39  -0.11450 -1.0 2.0
   61    56    58    39   0.24250  1.0 3.0
   44    38    42    43   0.00000  1.0 1.0
   44    38    42    46   0.09850  1.0 1.0
   44    38    42    46   0.15250 -1.0 2.0
   44    38    42    46  -0.50650  1.0 3.0
   44    38    42    61   0.80850  1.0 1.0
   44    38    42    61  -0.47300 -1.0 2.0
   44    38    42    61  -0.52300  1.0 3.0
   45    44    49    50   0.00000  1.0 1.0
   45    44    49    51   0.00000  1.0 1.0
   45    44    49    52   0.00000  1.0 1.0
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
   33    42    38    44   1.10000 -1.0 2.0
   49    45    44    38   1.10000 -1.0 2.0
END
