* LIGAND DATABASE FILE (OPLS2005)
*
001      62    63    117    182     346
    1     0 S   NP   _N1_     1    28.08001    95.36820   -23.99346
    2     1 S   H    _HN1     2     1.02835    25.82640   164.79838
    3     1 S   H    _H1_     3     1.02777   110.35856  -106.03828
    4     1 S   H    _H2_     4     1.02957    82.22277     0.69970
    5     1 S   CT   _CA1     5     1.50147   128.03461   110.55475
    6     5 S   HC   _HA1     6     1.09577   105.18651    81.41170
    7     5 S   CO3  _C1_     7     1.53761   112.32735   -38.72496
    8     7 S   O2Z  _O11     8     1.26367   114.98712   -44.24269
    9     7 S   O2Z  _O12     9     1.26229   114.91778   134.70604
   10     5 S   CT   _CB1    10     1.53081   107.40534  -160.72421
   11    10 S   HC   HB11    11     1.09832   109.25766   -50.43641
   12    10 S   HC   HB12    12     1.09814   110.46147    66.08972
   13    10 S   CT   _CG1    13     1.53048   112.72500  -171.49146
   14    13 S   HC   HG11    14     1.09589   110.54301   -65.87553
   15    13 S   HC   HG12    15     1.09661   109.87288    53.35141
   16    13 S   C    _CD1    16     1.51860   112.20490   173.67194
   17    16 S   O    _OE1    17     1.22775   123.23285     3.36779
   18    16 S   N    _N2_    18     1.38572   111.82917  -176.55542
   19    18 S   H    _HN2    19     1.01560   119.12282     3.37881
   20    18 S   CT1  _CA2    20     1.45784   122.72304   177.27897
   21    20 S   HC   _HA2    21     1.09759   108.78976    26.56551
   22    20 S   C    _C2_    22     1.53031   107.39100   -90.13447
   23    22 S   O    _O2_    23     1.22955   123.22305   -23.42780
   24    20 S   CT   _CB2    32     1.53141   112.39443   149.71251
   25    24 S   HC   HB21    33     1.09592   110.65644    52.57340
   26    24 S   HC   HB22    34     1.09449   109.83039   171.41160
   27    22 S   N    _N3_    24     1.38553   112.37558   159.08889
   28    27 S   H    _HN3    25     1.01664   120.20340    -2.18767
   29    24 S   S    _SG2    35     1.82329   111.23082   -68.25829
   30    27 S   CT   _CA3    26     1.45335   122.68205   178.37828
   31    30 S   HC   HA31    27     1.09559   108.04942   -51.24286
   32    30 S   HC   HA32    28     1.09552   107.43162    65.15707
   33    29 S   CT   _C11    36     1.82663    98.88807  -172.46193
   34    33 S   HC   _H7_    37     1.09550   106.29037   -59.33662
   35    30 S   CO3  _C3_    29     1.52923   114.21285  -173.19139
   36    35 S   O2Z  _O31    30     1.26357   116.05178     2.96847
   37    35 S   O2Z  _O32    31     1.26436   114.41892  -177.12969
   38    33 S   CM   _C12    38     1.50868   111.14770  -177.04640
   39    33 S   OS   _O33    53     1.43934   114.00059    56.46938
   40    38 S   CT   _C8_    39     1.49575   116.26525  -105.53733
   41    40 S   HC   _H4_    40     1.09967   108.64439   -86.64778
   42    38 S   CMA  _C13    60     1.51553   119.94032    94.30345
   43    42 S   OM   _O34    61     1.26168   120.38867   -75.43720
   44    42 S   OM   _O35    62     1.26247   120.76337   104.32349
   45    40 S   CT   _C7_    41     1.52557   118.59575   148.27484
   46    45 S   HC   _H13    42     1.09479   112.11216    85.06697
   47    45 S   HC   _H14    43     1.09697   111.28466   -35.44857
   48    45 S   CT   _C6_    44     1.53862   104.66301  -153.88142
   49    48 S   HC   _H11    45     1.09592   109.82034   131.73360
   50    48 S   HC   _H12    46     1.09570   110.88399  -109.80621
   51    48 S   CT   _C5_    47     1.54275   106.43505    10.05696
   52    51 S   HC   _H3_    48     1.09834   108.45454   -97.70819
   53    40 S   CT   _C9_    49     1.52327   108.43878    32.62923
   54    53 S   HC   _H5_    50     1.10123   110.07041    58.71450
   55    51 S   CT   _C4_    56     1.52008   112.91378   141.98163
   56    55 S   HC   _H8_    57     1.09511   111.45387   -61.13860
   57    55 S   HC   _H9_    58     1.09439   110.89036   178.49390
   58    55 S   HC   _H10    59     1.09496   110.56115    58.92065
   59    53 S   CO   _C10    51     1.52741   110.47923   -61.59047
   60    59 S   HC   _H6_    52     1.09575   109.99798   -85.14727
   61    59 S   OH   _O36    54     1.42443   108.98799   157.46998
   62    61 S   HO   _H15    55     0.97204   106.78434   157.33740
  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
  13   5   2   1   1  14   9  18   9   4   1   1  11   6   5  11
   5   4  10   7   9   4   4   2   1   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    40    59    39    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    40    41    45    53    59    60    39    61    42    43    44  
   38    40    59    39    42  
   36    37  
   37  
    0  
   40    41    45    46    47    48    51    53    54    59    39    42    43    44  
   61    62    42    40    51    53    54    59    60  
   41    45    46    47    48    49    50    51    52    53    54    59    60    61    55    42    43    44  
   45    46    47    48    51    53    54    59    42  
   43    44    45    53  
   44  
    0  
   46    47    48    49    50    51    52    53    54    59    55  
   47    48    49    50    51    53  
   48    49    50    51    53  
   49    50    51    52    53    54    59    55    56    57    58  
   50    51    52    53    55  
   51    52    53    55  
   52    53    54    59    60    61    55    56    57    58  
   53    54    59    55    56    57    58  
   54    59    60    61    62    55    56    57    58  
   59    60    61    55  
   56    57    58    59  
   57    58  
   58  
    0  
   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  -0.316400   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   0.387900   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.030000   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  -0.670200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   40   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760   0.149000   2.0020   1.7750   0.023028004  -0.852763146
   43   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   44   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   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  -0.120000   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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660   0.264700   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   61   3.1200   0.1700  -0.582700   1.7660   1.5600   0.021068034  -0.322181743
   62   0.5000   0.0300   0.418000   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   320.000  1.410
   38    40   317.000  1.510
   38    42   465.000  1.376
   40    41   340.000  1.090
   40    45   268.000  1.529
   40    53   268.000  1.529
   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   268.000  1.529
   51    52   340.000  1.090
   51    53   268.000  1.529
   51    55   268.000  1.529
   53    54   340.000  1.090
   53    59   250.000  1.527
   59    60   340.000  1.090
   59    39   320.000  1.380
   59    61   380.000  1.407
   61    62   553.000  0.945
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   42    43   745.000  1.250
   42    44   745.000  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    39    85.00000  114.68000
   33    38    40    65.00000  117.92700
   33    38    42    70.00000  124.00000
   33    39    59    60.00000  109.50000
   38    33    34    35.00000  109.50000
   38    40    41    35.00000  109.50000
   38    40    45    70.00000  112.02700
   38    40    53    70.00000  112.02700
   38    42    43    65.00000  137.10300
   38    42    44    65.00000  137.10300
   40    45    46    37.50000  110.70000
   40    45    47    37.50000  110.70000
   40    45    48    58.35000  112.70000
   40    53    51    58.35000  112.70000
   40    53    54    37.50000  110.70000
   40    53    59    75.00000  109.43000
   45    40    41    37.50000  110.70000
   45    48    49    37.50000  110.70000
   45    48    50    37.50000  110.70000
   45    48    51    58.35000  112.70000
   47    45    46    33.00000  107.80000
   48    45    46    37.50000  110.70000
   48    45    47    37.50000  110.70000
   48    51    52    37.50000  110.70000
   48    51    53    58.35000  112.70000
   48    51    55    58.35000  112.70000
   50    48    49    33.00000  107.80000
   51    48    49    37.50000  110.70000
   51    48    50    37.50000  110.70000
   51    53    54    37.50000  110.70000
   51    53    59    75.00000  109.43000
   51    55    56    37.50000  110.70000
   51    55    57    37.50000  110.70000
   51    55    58    37.50000  110.70000
   53    40    41    37.50000  110.70000
   53    40    45    58.35000  112.70000
   53    51    52    37.50000  110.70000
   53    59    60    45.00000  112.01100
   53    59    39    90.00000  108.56700
   53    59    61    90.00000  110.19100
   59    53    54    45.00000  108.72000
   59    61    62    70.00000  107.92000
   39    33    34    35.00000  109.50000
   39    33    38    85.00000  110.90400
   39    59    60    35.00000  109.50000
   61    59    60    60.00000  108.02500
   61    59    39   110.00000  112.08000
   55    51    52    37.50000  110.70000
   55    51    53    58.35000  112.70000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   42    38    40    70.00000  124.00000
   44    42    43    65.00000  121.00000
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    39   0.13850  1.0 1.0
   24    29    33    39  -1.34450 -1.0 2.0
   24    29    33    39   0.57400  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    40   0.30250  1.0 1.0
   29    33    38    40  -0.14950 -1.0 2.0
   29    33    38    40   0.36900  1.0 3.0
   29    33    38    42   0.42700  1.0 1.0
   29    33    38    42  -0.70350 -1.0 2.0
   29    33    38    42  -0.43150  1.0 3.0
   29    33    39    59   0.14700  1.0 1.0
   29    33    39    59  -1.16150 -1.0 2.0
   29    33    39    59   0.48700  1.0 3.0
   33    38    40    41   0.34800  1.0 3.0
   33    38    40    45   0.46850  1.0 1.0
   33    38    40    45   0.08550 -1.0 2.0
   33    38    40    45   0.09800  1.0 3.0
   33    38    40    53   0.46850  1.0 1.0
   33    38    40    53   0.08550 -1.0 2.0
   33    38    40    53   0.09800  1.0 3.0
   33    38    42    43   7.00000 -1.0 2.0
   33    38    42    44   7.00000 -1.0 2.0
   34    33    38    40   0.34800  1.0 3.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    39    59   0.37050  1.0 3.0
   38    33    39    59  -0.77900  1.0 1.0
   38    33    39    59  -0.36900 -1.0 2.0
   38    33    39    59   0.40400  1.0 3.0
   38    40    45    46   0.15000  1.0 3.0
   38    40    45    47   0.15000  1.0 3.0
   38    40    45    48   0.34400  1.0 1.0
   38    40    45    48   0.09450 -1.0 2.0
   38    40    45    48   0.11100  1.0 3.0
   38    40    53    51   0.34400  1.0 1.0
   38    40    53    51   0.09450 -1.0 2.0
   38    40    53    51   0.11100  1.0 3.0
   38    40    53    54   0.15000  1.0 3.0
   38    40   -53    59   0.34400  1.0 1.0
   38    40   -53    59   0.09450 -1.0 2.0
   38    40   -53    59   0.11100  1.0 3.0
   40    38    42    43   7.00000 -1.0 2.0
   40    38    42    44   7.00000 -1.0 2.0
   40    45    48    49   0.15000  1.0 3.0
   40    45    48    50   0.15000  1.0 3.0
   40    45   -48    51   0.56750  1.0 1.0
   40    45   -48    51  -0.07550 -1.0 2.0
   40    45   -48    51   0.20000  1.0 3.0
   40    53    59    60   0.15000  1.0 3.0
   40    53    59    39   0.62750  1.0 1.0
   40    53    59    39  -0.30950 -1.0 2.0
   40    53    59    39   0.27300  1.0 3.0
   40    53    59    61   0.86500  1.0 1.0
   40    53    59    61  -0.17500 -1.0 2.0
   40    53    59    61   0.20800  1.0 3.0
   41    40    45    46   0.15000  1.0 3.0
   41    40    45    47   0.15000  1.0 3.0
   41    40    45    48   0.15000  1.0 3.0
   41    40    53    51   0.15000  1.0 3.0
   41    40    53    54   0.15000  1.0 3.0
   41    40    53    59   0.15000  1.0 3.0
   45    40   -53    51   0.56750  1.0 1.0
   45    40   -53    51  -0.07550 -1.0 2.0
   45    40   -53    51   0.20000  1.0 3.0
   45    40    53    54   0.15000  1.0 3.0
   45    40    53    59   3.97050  1.0 1.0
   45    48    51    52   0.15000  1.0 3.0
   45    48   -51    53   0.56750  1.0 1.0
   45    48   -51    53  -0.07550 -1.0 2.0
   45    48   -51    53   0.20000  1.0 3.0
   45    48    51    55   0.56750  1.0 1.0
   45    48    51    55  -0.07550 -1.0 2.0
   45    48    51    55   0.20000  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   0.15000  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   0.15000  1.0 3.0
   48    51   -53    40   0.56750  1.0 1.0
   48    51   -53    40  -0.07550 -1.0 2.0
   48    51   -53    40   0.20000  1.0 3.0
   48    51    53    54   0.15000  1.0 3.0
   48    51    53    59   3.97050  1.0 1.0
   48    51    55    56   0.15000  1.0 3.0
   48    51    55    57   0.15000  1.0 3.0
   48    51    55    58   0.15000  1.0 3.0
   49    48    51    52   0.15000  1.0 3.0
   49    48    51    53   0.15000  1.0 3.0
   49    48    51    55   0.15000  1.0 3.0
   50    48    51    52   0.15000  1.0 3.0
   50    48    51    53   0.15000  1.0 3.0
   50    48    51    55   0.15000  1.0 3.0
   51    53    59    60   0.15000  1.0 3.0
   51    53    59    39   0.62750  1.0 1.0
   51    53    59    39  -0.30950 -1.0 2.0
   51    53    59    39   0.27300  1.0 3.0
   51    53    59    61   0.86500  1.0 1.0
   51    53    59    61  -0.17500 -1.0 2.0
   51    53    59    61   0.20800  1.0 3.0
   52    51    53    40   0.15000  1.0 3.0
   52    51    53    54   0.15000  1.0 3.0
   52    51    53    59   0.15000  1.0 3.0
   52    51    55    56   0.15000  1.0 3.0
   52    51    55    57   0.15000  1.0 3.0
   52    51    55    58   0.15000  1.0 3.0
   53    40    45    46   0.15000  1.0 3.0
   53    40    45    47   0.15000  1.0 3.0
   53    40   -45    48   0.56750  1.0 1.0
   53    40   -45    48  -0.07550 -1.0 2.0
   53    40   -45    48   0.20000  1.0 3.0
   53    51    55    56   0.15000  1.0 3.0
   53    51    55    57   0.15000  1.0 3.0
   53    51    55    58   0.15000  1.0 3.0
   53    59   -39    33   0.06250  1.0 1.0
   53    59   -39    33  -0.01100 -1.0 2.0
   53    59   -39    33   0.28050  1.0 3.0
   53    59    61    62  -0.11600  1.0 1.0
   53    59    61    62  -0.09450 -1.0 2.0
   53    59    61    62   0.21250  1.0 3.0
   54    53    59    60   0.15000  1.0 3.0
   54    53    59    39   0.23400  1.0 3.0
   54    53    59    61   0.23400  1.0 3.0
   60    59    39    33   0.37050  1.0 3.0
   60    59    61    62   0.19450  1.0 3.0
   39    33   -38    40   0.09700  1.0 1.0
   39    33   -38    40   0.15600 -1.0 2.0
   39    33   -38    40  -0.50800  1.0 3.0
   39    33    38    42   0.39000  1.0 1.0
   39    33    38    42  -0.05800 -1.0 2.0
   39    33    38    42  -0.55150  1.0 3.0
   39    59    61    62  -0.50000  1.0 1.0
   39    59    61    62  -0.73950 -1.0 2.0
   39    59    61    62   0.17150  1.0 3.0
   61    59    39    33  -0.81800  1.0 1.0
   55    51    53    40   0.56750  1.0 1.0
   55    51    53    40  -0.07550 -1.0 2.0
   55    51    53    40   0.20000  1.0 3.0
   55    51    53    54   0.15000  1.0 3.0
   55    51    53    59   3.97050  1.0 1.0
   42    38    40    41   0.00000  1.0 1.0
   42    38    40    45   0.09850  1.0 1.0
   42    38    40    45   0.15250 -1.0 2.0
   42    38    40    45  -0.50650  1.0 3.0
   42    38    40    53   0.09850  1.0 1.0
   42    38    40    53   0.15250 -1.0 2.0
   42    38    40    53  -0.50650  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   33    40    38    42   1.10000 -1.0 2.0
   43    44    42    38   1.10000 -1.0 2.0
END
