* LIGAND DATABASE FILE (OPLS2005)
*
001      61    61    107    162     314
    1     0 S   NP   _N1_     1    27.99152    95.95150   -23.79776
    2     1 S   H    _HN1     2     1.02957    81.92654    -2.99134
    3     1 S   H    _H1_     3     1.02835    28.29305   149.68139
    4     1 S   H    _H2_     4     1.02776   104.77270  -109.92118
    5     1 S   CT   _CA1     5     1.50128   133.69986   107.56832
    6     5 S   HC   _HA1     6     1.09575   105.21799    79.05396
    7     5 S   CO3  _C1_     7     1.53784   112.35686   -41.14166
    8     7 S   O2Z  _O11     8     1.26365   114.99799   -44.07588
    9     7 S   O2Z  _O12     9     1.26235   114.92812   135.02552
   10     5 S   CT   _CB1    10     1.53095   107.42138  -163.03747
   11    10 S   HC   HB11    11     1.09828   109.33357   -50.53318
   12    10 S   HC   HB12    12     1.09815   110.42617    66.02060
   13    10 S   CT   _CG1    13     1.53018   112.67316  -171.60492
   14    13 S   HC   HG11    14     1.09595   110.49328   -64.31820
   15    13 S   HC   HG12    15     1.09656   109.92212    54.88592
   16    13 S   C    _CD1    16     1.51840   112.30815   175.25352
   17    16 S   O    _OE1    17     1.22749   123.28883     0.27906
   18    16 S   N    _N2_    18     1.38558   111.71233  -179.70525
   19    18 S   H    _HN2    19     1.01554   119.04464     4.43950
   20    18 S   CT1  _CA2    20     1.45859   122.87798   178.03268
   21    20 S   HC   _HA2    21     1.09716   108.94266    24.31289
   22    20 S   C    _C2_    22     1.52897   106.81753   -92.90367
   23    22 S   O    _O2_    23     1.23000   122.94850   -28.76559
   24    20 S   CT   _CB2    32     1.53172   112.22564   147.52457
   25    24 S   HC   HB21    33     1.09536   110.07388    55.51845
   26    24 S   HC   HB22    34     1.09535   110.15217   174.38434
   27    22 S   N    _N3_    24     1.38477   112.69040   154.03634
   28    27 S   H    _HN3    25     1.01667   120.39394    -2.23336
   29    24 S   S    _SG2    35     1.82607   111.17811   -65.54480
   30    27 S   CT   _CA3    26     1.45360   122.36723   178.59793
   31    30 S   HC   HA31    27     1.09574   107.67891   -57.44221
   32    30 S   HC   HA32    28     1.09564   107.71154    58.84400
   33    29 S   CT   _C10    36     1.83365    99.54327   179.69290
   34    33 S   HC   _H4_    37     1.09541   108.61580    38.56232
   35    30 S   CO3  _C3_    29     1.52864   114.41993  -179.42563
   36    35 S   O2Z  _O31    30     1.26315   116.08829    -4.64928
   37    35 S   O2Z  _O32    31     1.26440   114.40088   175.38815
   38    33 S   CM   _C9_    38     1.50468   109.37273   -79.98023
   39    38 S   HC   _H9_    39     1.08717   117.56998    69.68419
   40    38 S   CM   _C8_    40     1.34155   124.14229  -112.61786
   41    40 S   HC   _H8_    41     1.08682   118.70654  -177.49517
   42    40 S   CT   _C7_    42     1.50931   123.87717     1.62582
   43    42 S   HC   _H3_    43     1.09982   107.52366  -108.92629
   44    42 S   CT   _C13    44     1.54850   112.98576    12.77255
   45    44 S   HC   _H5_    45     1.09701   110.02187    85.97016
   46    42 S   OS   _O35    54     1.44262   107.37101   130.78218
   47    33 S   CM   _C11    46     1.50415   108.52512   157.38331
   48    44 S   NP   _N4_    50     1.49489   107.80478  -160.88692
   49    48 S   H    _H10    51     1.02845   110.91232    68.12259
   50    48 S   H    _H11    52     1.03212   112.21802   -52.34455
   51    48 S   H    _H12    53     1.02887   110.39231  -173.87593
   52    46 S   CM   _C5_    55     1.38310   113.28762   102.73174
   53    47 S   CMA  _C12    47     1.51218   120.30826   -95.77267
   54    53 S   OM   _O36    48     1.26116   120.41806   -69.39033
   55    53 S   OM   _O37    49     1.26174   120.35603   112.36737
   56    52 S   CM   _C4_    56     1.33736   120.70659  -115.28642
   57    56 S   HC   _H6_    57     1.08490   120.62189     2.91417
   58    56 S   HC   _H7_    58     1.08468   121.93928  -176.92942
   59    52 S   CO3  _C6_    59     1.54457   118.29166    70.45086
   60    59 S   O2Z  _O34    60     1.26381   116.08424  -154.43020
   61    59 S   O2Z  _O33    61     1.26668   114.79429    25.03165
  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   8   5   4   3
  13   6   2   1   1   9   4   9   4  13   6  11   7   9   7   4
   2   1   1   6   2   1   1   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    47    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    44    47    53  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    44    45    47    53    54    55    48  
   38    39    40    44    47    53  
   36    37  
   37  
    0  
   39    40    41    42    43    44    47    53    46  
   40    41    42    47  
   41    42    43    44    45    47    48    46    52  
   42    43    44    46  
   43    44    45    47    53    48    49    50    51    46    52    56    59  
   44    45    47    48    46    52  
   45    47    53    54    55    48    49    50    51    46    52  
   47    53    48    49    50    51    46  
   52    56    57    58    59    60    61    47    48  
   53    54    55    48    49    50    51  
   49    50    51    53  
   50    51  
   51  
    0  
   56    57    58    59    60    61  
   54    55  
   55  
    0  
   57    58    59    60    61  
   58    59  
   59  
   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760  -0.184000   2.0020   1.7750   0.023028004  -0.852763146
   41   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5000   0.0660   0.463400   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.030000   1.6450   1.4500   0.008598240   0.268726247
   44   3.5000   0.0660   0.025600   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   46   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   47   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   48   3.2500   0.1700  -0.300000   2.2900   2.0360   0.003973653   1.685851020
   49   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   50   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   51   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   52   3.5500   0.0760  -0.225300   2.0020   1.7750   0.023028004  -0.852763146
   53   3.5500   0.0760   0.149000   2.0020   1.7750   0.023028004  -0.852763146
   54   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   55   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   56   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   57   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   58   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   59   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   60   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   61   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
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    47   317.000  1.510
   38    39   340.000  1.080
   38    40   549.000  1.340
   40    41   340.000  1.080
   40    42   317.000  1.510
   42    43   340.000  1.090
   42    44   268.000  1.529
   42    46   320.000  1.410
   44    45   340.000  1.090
   44    47   317.000  1.510
   44    48   367.000  1.471
   47    53   465.000  1.376
   53    54   745.000  1.250
   53    55   745.000  1.250
   48    49   434.000  1.010
   48    50   434.000  1.010
   48    51   434.000  1.010
   46    52   440.000  1.360
   52    56   549.000  1.340
   52    59   230.000  1.545
   56    57   340.000  1.080
   56    58   340.000  1.080
   59    60   656.000  1.250
   59    61   656.000  1.250
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    47    75.00000  112.20000
   33    38    39    35.00000  117.00000
   33    38    40    70.00000  124.00000
   33    47    44    65.00000  117.92700
   33    47    53    70.00000  124.00000
   38    33    34    35.00000  109.50000
   38    40    41    35.00000  120.00000
   38    40    42    70.00000  124.00000
   40    38    39    35.00000  120.00000
   40    42    43    35.00000  109.50000
   40    42    44    70.00000  112.02700
   40    42    46    85.00000  110.90400
   42    40    41    35.00000  117.00000
   42    44    45    37.50000  110.70000
   42    44    47    70.00000  112.02700
   42    44    48    80.00000  111.20000
   42    46    52    90.00000  111.18400
   44    42    43    37.50000  110.70000
   44    47    53    70.00000  124.00000
   44    48    49    35.00000  109.50000
   44    48    50    35.00000  109.50000
   44    48    51    35.00000  109.50000
   47    33    34    35.00000  109.50000
   47    33    38    70.00000  110.12100
   47    44    45    35.00000  109.50000
   47    53    54    65.00000  137.10300
   47    53    55    65.00000  137.10300
   55    53    54    65.00000  121.00000
   48    44    45    35.00000  109.50000
   48    44    47    75.00000  110.06800
   50    48    49    35.00000  109.50000
   51    48    49    35.00000  109.50000
   51    48    50    35.00000  109.50000
   46    42    43    35.00000  109.50000
   46    42    44    50.00000  109.50000
   46    52    56    80.00000  120.01400
   46    52    59    80.00000  119.00000
   52    56    57    35.00000  120.00000
   52    56    58    35.00000  120.00000
   52    59    60    85.00000  113.83300
   52    59    61    85.00000  113.83300
   58    56    57    35.00000  117.00000
   59    52    56    55.00000  124.75400
   61    59    60    80.00000  126.00000
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    47  -0.62250  1.0 1.0
   24    29    33    47  -0.38450 -1.0 2.0
   24    29    33    47   0.81900  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   0.00000  1.0 1.0
   29    33    38    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    47    44   0.30250  1.0 1.0
   29    33    47    44  -0.14950 -1.0 2.0
   29    33    47    44   0.36900  1.0 3.0
   29    33    47    53   0.42700  1.0 1.0
   29    33    47    53  -0.70350 -1.0 2.0
   29    33    47    53  -0.43150  1.0 3.0
   33    38    40    41   7.00000 -1.0 2.0
   33    38    40    42   7.00000 -1.0 2.0
   33    47    53    54   7.00000 -1.0 2.0
   33    47    53    55   7.00000 -1.0 2.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    47    44   0.34800  1.0 3.0
   34    33    47    53   0.00000  1.0 1.0
   38    33    47    44   0.09700  1.0 1.0
   38    33    47    44   0.15600 -1.0 2.0
   38    33    47    44  -0.50800  1.0 3.0
   38    33    47    53  -0.28300  1.0 1.0
   38    33    47    53   0.26700 -1.0 2.0
   38    33    47    53  -0.63300  1.0 3.0
   38    40    42    43   0.00000  1.0 1.0
   38    40   -42    44   0.09850  1.0 1.0
   38    40   -42    44   0.15250 -1.0 2.0
   38    40   -42    44  -0.50650  1.0 3.0
   38    40    42    46   0.39000  1.0 1.0
   38    40    42    46  -0.05800 -1.0 2.0
   38    40    42    46  -0.55150  1.0 3.0
   39    38    40    41   7.00000 -1.0 2.0
   39    38    40    42   7.00000 -1.0 2.0
   40    42    44    45   0.15000  1.0 3.0
   40    42    44    47   0.31000  1.0 1.0
   40    42    44    47   0.14700 -1.0 2.0
   40    42    44    47   0.07550  1.0 3.0
   40    42    44    48  -0.47300  1.0 1.0
   40    42    44    48   0.29700 -1.0 2.0
   40    42    44    48   0.83300  1.0 3.0
   40    42    46    52  -0.48150  1.0 1.0
   40    42    46    52   0.09250 -1.0 2.0
   40    42    46    52  -0.12850  1.0 3.0
   41    40    42    43   0.33100  1.0 3.0
   41    40    42    44   0.00000  1.0 1.0
   41    40    42    46   0.00000  1.0 1.0
   42    44   -47    33   0.46850  1.0 1.0
   42    44   -47    33   0.08550 -1.0 2.0
   42    44   -47    33   0.09800  1.0 3.0
   42    44    47    53   0.09850  1.0 1.0
   42    44    47    53   0.15250 -1.0 2.0
   42    44    47    53  -0.50650  1.0 3.0
   42    44    48    49   0.17350  1.0 3.0
   42    44    48    50   0.17350  1.0 3.0
   42    44    48    51   0.17350  1.0 3.0
   42    46    52    56  -2.26850  1.0 1.0
   42    46    52    56   3.39050 -1.0 2.0
   42    46    52    59   0.15100 -1.0 2.0
   43    42    44    45   0.15000  1.0 3.0
   43    42    44    47   0.15000  1.0 3.0
   43    42    44    48   0.19200  1.0 3.0
   43    42    46    52   0.08050  1.0 3.0
   44    42    46    52  -0.46850  1.0 1.0
   44    42    46    52   0.09300 -1.0 2.0
   44    42    46    52  -0.12850  1.0 3.0
   44    47    53    54   7.00000 -1.0 2.0
   44    47    53    55   7.00000 -1.0 2.0
   45    44    47    33   0.34800  1.0 3.0
   45    44    47    53   0.00000  1.0 1.0
   45    44    48    49   0.13050  1.0 3.0
   45    44    48    50   0.13050  1.0 3.0
   45    44    48    51   0.13050  1.0 3.0
   47    33    38    39   0.00000  1.0 1.0
   47    33   -38    40  -0.28300  1.0 1.0
   47    33   -38    40   0.26700 -1.0 2.0
   47    33   -38    40  -0.63300  1.0 3.0
   47    44    48    49   0.17350  1.0 3.0
   47    44    48    50   0.17350  1.0 3.0
   47    44    48    51   0.17350  1.0 3.0
   48    44    47    33   0.52100  1.0 1.0
   48    44    47    33  -0.20350 -1.0 2.0
   48    44    47    33   0.29750  1.0 3.0
   48    44    47    53   0.80850  1.0 1.0
   48    44    47    53  -0.47300 -1.0 2.0
   48    44    47    53  -0.52300  1.0 3.0
   46    42    44    45   0.23400  1.0 3.0
   46    42    44    47   0.61850  1.0 1.0
   46    42    44    47  -0.22750 -1.0 2.0
   46    42    44    47   0.15300  1.0 3.0
   46    42    44    48   1.69300  1.0 1.0
   46    42    44    48  -0.48450 -1.0 2.0
   46    52    56    57   7.00000 -1.0 2.0
   46    52    56    58   7.00000 -1.0 2.0
   46    52    59    60  -0.11900  1.0 1.0
   46    52    59    60   0.76850 -1.0 2.0
   46    52    59    60   0.14100  1.0 3.0
   46    52    59    61  -0.11900  1.0 1.0
   46    52    59    61   0.76850 -1.0 2.0
   46    52    59    61   0.14100  1.0 3.0
   56    52    59    60  -0.04000 -1.0 2.0
   56    52    59    60  -0.29050  1.0 3.0
   56    52    59    61  -0.04000 -1.0 2.0
   56    52    59    61  -0.29050  1.0 3.0
   59    52    56    57   7.00000 -1.0 2.0
   59    52    56    58   7.00000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   33    39    38    40   1.10000 -1.0 2.0
   42    41    40    38   1.10000 -1.0 2.0
   33    44    47    53   1.10000 -1.0 2.0
   54    55    53    47   1.10000 -1.0 2.0
   46    59    52    56  15.00000 -1.0 2.0
   57    58    56    52  15.00000 -1.0 2.0
   60    52    59    61  10.50000 -1.0 2.0
END
