* LIGAND DATABASE FILE (OPLS2005)
*
001      62    62    110    159     314
    1     0 S   NP   _N1_     1    29.10261    96.09271   -19.89411
    2     1 S   H    _HN1     2     1.02775    81.18669   -76.79360
    3     1 S   H    _H1_     3     1.02957    84.56552    32.80742
    4     1 S   H    _H2_     4     1.02826    43.23083   154.90774
    5     1 S   CT   _CA1     5     1.50186   153.89336   159.52852
    6     5 S   HC   _HA1     6     1.09576   105.13670    55.82518
    7     5 S   CO3  _C1_     7     1.53792   112.36912   -64.18273
    8     7 S   O2Z  _O11     8     1.26370   114.97594   -40.92533
    9     7 S   O2Z  _O12     9     1.26236   114.95741   137.88664
   10     5 S   CT   _CB1    10     1.53070   107.34716   173.68081
   11    10 S   HC   HB11    11     1.09819   109.20750   -49.48587
   12    10 S   HC   HB12    12     1.09817   110.49165    67.08347
   13    10 S   CT   _CG1    13     1.52960   112.70451  -170.58589
   14    13 S   HC   HG11    14     1.09518   110.45852   -65.37906
   15    13 S   HC   HG12    15     1.09667   109.99741    53.67502
   16    13 S   C    _CD1    16     1.51847   112.33146   173.55460
   17    16 S   O    _OE1    17     1.22738   123.27071    -7.09749
   18    16 S   N    _N2_    18     1.38549   111.60722   174.16178
   19    18 S   H    _HN2    19     1.01595   118.97900    -1.10553
   20    18 S   CT1  _CA2    20     1.46214   123.61299   177.60412
   21    20 S   HC   _HA2    21     1.09736   109.39271    -4.07448
   22    20 S   C    _C2_    22     1.53496   108.47033  -119.40981
   23    22 S   O    _O2_    23     1.23052   122.42282  -149.32090
   24    20 S   CT   _CB2    32     1.53289   111.33397   118.14509
   25    24 S   HC   HB21    33     1.09459   109.63177    55.38541
   26    24 S   HC   HB22    34     1.09531   110.52768   173.32809
   27    22 S   N    _N3_    24     1.38397   113.59363    38.38959
   28    27 S   H    _HN3    25     1.01618   119.44966    -3.91732
   29    24 S   S    _SG2    35     1.83453   110.98909   -68.51339
   30    27 S   CT   _CA3    26     1.45267   123.13307   176.88567
   31    30 S   HC   HA31    27     1.09553   107.56523   -62.96755
   32    30 S   HC   HA32    28     1.09559   107.89854    53.42520
   33    29 S   CT   _C10    36     1.84574   102.23799   134.93742
   34    33 S   OM   _O13    37     1.31458   112.07843    54.98124
   35    30 S   CO3  _C3_    29     1.52926   114.16653   175.40155
   36    35 S   O2Z  _O31    30     1.26361   116.09008     0.02798
   37    35 S   O2Z  _O32    31     1.26436   114.39775  -179.95154
   38    33 S   CM   _C4_    38     1.52710   108.63295   177.32424
   39    38 S   CMA  _C5_    39     1.35974   118.14147   109.76949
   40    39 S   OM   _O33    40     1.26499   131.88798  -178.37924
   41    38 S   CT   _C12    59     1.51480   119.41214   -69.59592
   42    41 S   HC   _H20    60     1.09477   110.75269   -64.14078
   43    41 S   HC   _H21    61     1.09474   112.63096   176.20213
   44    41 S   HC   _H22    62     1.09417   111.00793    56.51536
   45    39 S   CT   _C11    41     1.54123   114.20600     0.06561
   46    33 S   S    _S15    42     1.82742   110.08885   -68.21455
   47    45 S   CM   _C8_    43     1.53152   116.73975   127.60608
   48    47 S   HC   _H19    44     1.09199   112.18599   132.90181
   49    45 S   CT   _C14    55     1.54806   110.36873  -106.11207
   50    49 S   HC   _H26    56     1.09696   111.77802   172.94615
   51    49 S   HC   _H27    57     1.09710   112.27641    51.70636
   52    49 S   HC   _H28    58     1.09734   111.24696   -68.12061
   53    47 S   CM   _C9_    45     1.35338   132.42976   -46.84901
   54    53 S   CM   _C7_    46     1.45802   124.33453    -1.71338
   55    54 S   HC   _H18    47     1.08450   117.39101    -1.93846
   56    53 S   CT   _C13    51     1.51173   118.57632   179.12508
   57    56 S   HC   _H23    52     1.09558   110.70084  -119.17349
   58    56 S   HC   _H24    53     1.09562   110.74329   119.84946
   59    56 S   HC   _H25    54     1.09578   112.48347     0.32506
   60    54 S   CM   _C6_    48     1.33976   126.77200   178.41168
   61    60 S   HC   _H16    49     1.08552   119.75191   179.84174
   62    60 S   HC   _H17    50     1.08331   123.15449    -0.26834
  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
  12   5   2   1   1  10  14   5   5   2   1   1  10   7  13   4
   4   2   1   1   9   8   4   4   2   1   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    46    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    45    46    41  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    45    46    47    49    41    42    43    44  
   38    39    45    46    41  
   36    37  
   37  
    0  
   39    40    45    46    47    49    41    42    43    44  
   40    45    46    47    48    53    49    50    51    52    41    42    43    44  
   45    46    47    49    41  
   42    43    44    45    46  
   43    44  
   44  
    0  
   46    47    48    53    54    56    49    50    51    52  
   47    48    53    49    50    51    52  
   48    53    54    55    60    56    57    58    59    49    50    51    52  
   53    54    56    49  
   50    51    52    53  
   51    52  
   52  
    0  
   54    55    60    61    62    56    57    58    59  
   55    60    61    62    56    57    58    59  
   60    61    62    56  
   57    58    59    60  
   58    59  
   59  
    0  
   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  -0.175000   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   4.2000   0.3000  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   34   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   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   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   40   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   41   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   46   3.6000   0.3550  -0.175000   2.0300   1.8000   0.025682759  -1.666211680
   47   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   48   2.4200   0.0300   0.115000   1.4250   1.2500   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   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   54   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   55   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   61   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   62   2.4200   0.0300   0.115000   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    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   570.000  1.307
   33    38   317.000  1.510
   33    46   222.000  1.810
   38    39   465.000  1.376
   38    41   317.000  1.510
   39    40   745.000  1.250
   39    45   270.000  1.512
   45    46   222.000  1.810
   45    47   317.000  1.510
   45    49   268.000  1.529
   47    48   340.000  1.080
   47    53   549.000  1.340
   53    54   380.000  1.444
   53    56   317.000  1.510
   54    55   340.000  1.080
   54    60   549.000  1.340
   60    61   340.000  1.080
   60    62   340.000  1.080
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   340.000  1.090
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   340.000  1.090
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    44   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    85.00000  114.68000
   29    33    38    75.00000  112.20000
   29    33    46    75.00000  118.28000
   33    38    39    70.00000  124.00000
   33    38    41    65.00000  117.92700
   33    46    45    62.00000   98.90000
   38    33    34    85.00000  110.90400
   38    39    40    65.00000  137.10300
   38    39    45    65.00000  122.18000
   38    41    42    35.00000  109.50000
   38    41    43    35.00000  109.50000
   38    41    44    35.00000  109.50000
   39    45    46    75.00000  112.20000
   39    45    47    70.00000  110.12100
   39    45    49    70.00000  112.02700
   45    39    40    85.00000  112.85300
   45    47    48    35.00000  117.00000
   45    47    53    70.00000  124.00000
   45    49    50    37.50000  110.70000
   45    49    51    37.50000  110.70000
   45    49    52    37.50000  110.70000
   46    33    34    85.00000  114.68000
   46    33    38    75.00000  112.20000
   47    45    46    75.00000  112.20000
   47    53    54    70.00000  123.01800
   47    53    56    70.00000  124.00000
   53    47    48    35.00000  120.00000
   53    54    55    35.00000  120.00000
   53    54    60    70.00000  123.01800
   53    56    57    35.00000  109.50000
   53    56    58    35.00000  109.50000
   53    56    59    35.00000  109.50000
   54    60    61    35.00000  120.00000
   54    60    62    35.00000  120.00000
   60    54    55    35.00000  120.00000
   62    60    61    35.00000  117.00000
   56    53    54    70.00000  124.00000
   58    56    57    33.00000  107.80000
   59    56    57    33.00000  107.80000
   59    56    58    33.00000  107.80000
   49    45    46    75.00000  111.63000
   49    45    47    70.00000  112.02700
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    33.00000  107.80000
   41    38    39    70.00000  124.00000
   43    41    42    33.00000  107.80000
   44    41    42    33.00000  107.80000
   44    41    43    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   0.13850  1.0 1.0
   24    29    33    34  -1.34450 -1.0 2.0
   24    29    33    34   0.57400  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    46   0.08500  1.0 1.0
   24    29    33    46  -0.53150 -1.0 2.0
   24    29    33    46   0.48050  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   0.42700  1.0 1.0
   29    33    38    39  -0.70350 -1.0 2.0
   29    33    38    39  -0.43150  1.0 3.0
   29    33    38    41   0.30250  1.0 1.0
   29    33    38    41  -0.14950 -1.0 2.0
   29    33    38    41   0.36900  1.0 3.0
   29    33    46    45   0.08500  1.0 1.0
   29    33    46    45  -0.53150 -1.0 2.0
   29    33    46    45   0.48050  1.0 3.0
   33    38    39    40   7.00000 -1.0 2.0
   33    38   -39    45   7.00000 -1.0 2.0
   33    38    41    42   0.34800  1.0 3.0
   33    38    41    43   0.34800  1.0 3.0
   33    38    41    44   0.34800  1.0 3.0
   34    33    38    39   0.39000  1.0 1.0
   34    33    38    39  -0.05800 -1.0 2.0
   34    33    38    39  -0.55150  1.0 3.0
   34    33    38    41   0.09700  1.0 1.0
   34    33    38    41   0.15600 -1.0 2.0
   34    33    38    41  -0.50800  1.0 3.0
   34    33    46    45   0.13850  1.0 1.0
   34    33    46    45  -1.34450 -1.0 2.0
   34    33    46    45   0.57400  1.0 3.0
   38    33   -46    45  -0.62250  1.0 1.0
   38    33   -46    45  -0.38450 -1.0 2.0
   38    33   -46    45   0.81900  1.0 3.0
   38    39   -45    46   0.42700  1.0 1.0
   38    39   -45    46  -0.70350 -1.0 2.0
   38    39   -45    46  -0.43150  1.0 3.0
   38    39    45    47  -0.28300  1.0 1.0
   38    39    45    47   0.26700 -1.0 2.0
   38    39    45    47  -0.63300  1.0 3.0
   38    39    45    49   0.09850  1.0 1.0
   38    39    45    49   0.15250 -1.0 2.0
   38    39    45    49  -0.50650  1.0 3.0
   39    38    41    42   0.00000  1.0 1.0
   39    38    41    43   0.00000  1.0 1.0
   39    38    41    44   0.00000  1.0 1.0
   39    45   -46    33  -0.62250  1.0 1.0
   39    45   -46    33  -0.38450 -1.0 2.0
   39    45   -46    33   0.81900  1.0 3.0
   39    45    47    48   0.00000  1.0 1.0
   39    45    47    53  -0.28300  1.0 1.0
   39    45    47    53   0.26700 -1.0 2.0
   39    45    47    53  -0.63300  1.0 3.0
   39    45    49    50   0.15000  1.0 3.0
   39    45    49    51   0.15000  1.0 3.0
   39    45    49    52   0.15000  1.0 3.0
   40    39    45    46   0.09700  1.0 1.0
   40    39    45    46   0.15600 -1.0 2.0
   40    39    45    46  -0.50800  1.0 3.0
   40    39    45    47   0.09700  1.0 1.0
   40    39    45    47   0.15600 -1.0 2.0
   40    39    45    47  -0.50800  1.0 3.0
   40    39    45    49   0.09700  1.0 1.0
   40    39    45    49   0.15600 -1.0 2.0
   40    39    45    49  -0.50800  1.0 3.0
   45    47    53    54   7.00000 -1.0 2.0
   45    47    53    56   7.00000 -1.0 2.0
   46    33   -38    39   0.42700  1.0 1.0
   46    33   -38    39  -0.70350 -1.0 2.0
   46    33   -38    39  -0.43150  1.0 3.0
   46    33    38    41   0.30250  1.0 1.0
   46    33    38    41  -0.14950 -1.0 2.0
   46    33    38    41   0.36900  1.0 3.0
   46    45    47    48   0.00000  1.0 1.0
   46    45    47    53   0.42700  1.0 1.0
   46    45    47    53  -0.70350 -1.0 2.0
   46    45    47    53  -0.43150  1.0 3.0
   46    45    49    50   0.15000  1.0 3.0
   46    45    49    51   0.15000  1.0 3.0
   46    45    49    52   0.15000  1.0 3.0
   47    45    46    33  -0.62250  1.0 1.0
   47    45    46    33  -0.38450 -1.0 2.0
   47    45    46    33   0.81900  1.0 3.0
   47    45    49    50   0.15000  1.0 3.0
   47    45    49    51   0.15000  1.0 3.0
   47    45    49    52   0.15000  1.0 3.0
   47    53    54    55  -0.18600  1.0 3.0
   47    53    54    60   0.28850  1.0 1.0
   47    53    54    60   2.61350 -1.0 2.0
   47    53    54    60   0.78400  1.0 3.0
   47    53    56    57   0.00000  1.0 1.0
   47    53    56    58   0.00000  1.0 1.0
   47    53    56    59   0.00000  1.0 1.0
   48    47    53    54   7.00000 -1.0 2.0
   48    47    53    56   7.00000 -1.0 2.0
   53    54    60    61   7.00000 -1.0 2.0
   53    54    60    62   7.00000 -1.0 2.0
   54    53    56    57   0.00000  1.0 1.0
   54    53    56    58   0.00000  1.0 1.0
   54    53    56    59   0.00000  1.0 1.0
   55    54    60    61   7.00000 -1.0 2.0
   55    54    60    62   7.00000 -1.0 2.0
   56    53    54    55   0.00000  1.0 1.0
   56    53    54    60  -0.18600  1.0 3.0
   49    45    46    33   0.01700  1.0 1.0
   49    45    46    33  -0.23550 -1.0 2.0
   49    45    46    33   0.21350  1.0 3.0
   49    45    47    48   0.00000  1.0 1.0
   49    45    47    53   0.09850  1.0 1.0
   49    45    47    53   0.15250 -1.0 2.0
   49    45    47    53  -0.50650  1.0 3.0
   41    38    39    40   7.00000 -1.0 2.0
   41    38    39    45   7.00000 -1.0 2.0
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
   37    30    35    36  10.50000 -1.0 2.0
   33    41    38    39   1.10000 -1.0 2.0
   45    40    39    38   1.10000 -1.0 2.0
   45    48    47    53  15.00000 -1.0 2.0
   54    56    53    47  15.00000 -1.0 2.0
   53    55    54    60  15.00000 -1.0 2.0
   61    62    60    54  15.00000 -1.0 2.0
END
