* LIGAND DATABASE FILE (OPLS2005)
*
001      60    61    110    170     323
    1     0 S   NP   _N1_     1    28.67872    94.02689   -21.96649
    2     1 S   H    _HN1     2     1.02839    25.38918   156.64249
    3     1 S   H    _H1_     3     1.02781    94.48733   -79.78982
    4     1 S   H    _H2_     4     1.02960    91.92809    28.74864
    5     1 S   CT   _CA1     5     1.50131   136.07295   151.27880
    6     5 S   HC   _HA1     6     1.09575   105.24080    61.68491
    7     5 S   CO3  _C1_     7     1.53811   112.26472   -58.53626
    8     7 S   O2Z  _O11     8     1.26360   115.00842   -46.12144
    9     7 S   O2Z  _O12     9     1.26229   114.90100   132.88982
   10     5 S   CT   _CB1    10     1.53077   107.41130   179.56299
   11    10 S   HC   HB11    11     1.09822   109.38672   -50.50787
   12    10 S   HC   HB12    12     1.09822   110.41225    66.05893
   13    10 S   CT   _CG1    13     1.53000   112.64811  -171.61409
   14    13 S   HC   HG11    14     1.09536   110.36352   -61.71001
   15    13 S   HC   HG12    15     1.09639   110.08176    57.42226
   16    13 S   C    _CD1    16     1.51813   112.19577   177.62587
   17    16 S   O    _OE1    17     1.22741   123.18169    -7.74468
   18    16 S   N    _N2_    18     1.38594   111.73803   172.85441
   19    18 S   H    _HN2    19     1.01608   119.11648     0.47064
   20    18 S   CT1  _CA2    20     1.46252   123.38046  -179.27719
   21    20 S   HC   _HA2    21     1.09733   109.37757    -8.48478
   22    20 S   C    _C2_    22     1.53472   108.76847  -124.19277
   23    22 S   O    _O2_    23     1.23042   122.12594  -148.87781
   24    20 S   CT   _CB2    32     1.53500   111.26605   113.49075
   25    24 S   HC   HB21    33     1.09268   109.08709    56.23874
   26    24 S   HC   HB22    34     1.09454   110.20179   174.84497
   27    22 S   N    _N3_    24     1.38476   113.54436    38.71805
   28    27 S   H    _HN3    25     1.01512   118.88953    -0.90590
   29    24 S   S    _SG2    35     1.82846   111.23091   -65.69283
   30    27 S   CT   _CA3    26     1.45442   123.50824   175.11332
   31    30 S   HC   HA31    27     1.09519   109.30337    23.27670
   32    30 S   HC   HA32    28     1.09498   107.11174   140.28344
   33    29 S   CT   _C12    36     1.88028   101.94977   162.79177
   34    30 S   CO3  _C3_    29     1.52910   113.04794  -100.24879
   35    34 S   O2Z  _O31    30     1.26407   115.37587   -45.31100
   36    34 S   O2Z  _O32    31     1.26350   115.00375   135.61032
   37    33 S   CM   _C5_    37     1.52022   105.54630   170.81168
   38    37 S   CM   _C4_    38     1.34180   121.20366   101.25852
   39    38 S   HC   _H16    39     1.08443   123.51383   178.80975
   40    37 S   CO4  _C6_    52     1.48086   122.41967   -81.22757
   41    40 S   O    _O13    53     1.22741   122.42314   166.82316
   42    38 S   NE   _N11    40     1.36490   124.16069    -0.72632
   43    42 S   H    _H26    41     1.01486   117.17994  -177.89587
   44    40 S   OS   _O14    54     1.35374   116.91802   -14.57427
   45    42 S   CT   _C11    42     1.45233   124.60150    -1.71429
   46    45 S   HC   _H22    43     1.09690   105.94317   138.96804
   47    44 S   CT   _C10    55     1.43714   124.30734     7.65783
   48    47 S   HC   _H20    56     1.09543   106.96240  -146.75001
   49    47 S   HC   _H21    57     1.09467   107.83042    98.94564
   50    33 S   CM   _C7_    44     1.56222   108.11746   -69.96543
   51    45 S   CT   _C13    48     1.52806   109.60342  -105.94363
   52    51 S   HC   _H23    49     1.09399   112.50823    53.09954
   53    51 S   HC   _H24    50     1.09634   110.12980   -65.44901
   54    51 S   HC   _H25    51     1.09489   111.32040   175.18415
   55    33 S   CT   _C9_    58     1.54058   111.27824    56.48558
   56    55 S   HC   _H18    59     1.09517   112.81571   -61.44322
   57    55 S   HC   _H19    60     1.09980   108.76397  -179.21316
   58    50 S   CMA  _C8_    45     1.36050   123.45823   103.34264
   59    58 S   OM   _O33    46     1.26055   132.90876   178.69030
   60    58 S   HC   _H17    47     1.08733   113.72921    -2.39237
  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  11   5   4   3
  20   2   1   1  14  11   4   8   2   9   4   6  10   6   6   4
   3  10   4   2   1   1   3   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    50    55    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    45    50    58    40    47    55    56    57  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    42    45    46    50    58    59    60    51    40    41    44    47    48    49    55    56    57  
   35    36  
   36  
    0  
   38    39    42    43    45    50    58    40    41    44    47    55    56    57  
   39    42    43    45    46    50    51    40    41    44    55  
   42    43    45    40  
   41    44    47    48    49    55    42    50  
   44    47  
   43    45    46    50    58    51    52    53    54  
   45    46    50    51  
   47    48    49    55    56    57  
   46    50    58    59    60    51    52    53    54    55  
   50    58    51    52    53    54  
   48    49    55    56    57    50  
   49    55    56    57  
   55    56    57  
   58    59    60    51    52    53    54    55    56    57  
   52    53    54    58  
   53    54  
   54  
    0  
   56    57    58  
   57  
    0  
   59    60  
   60  
    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   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5500   0.0760  -0.097000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   42   3.2500   0.1700  -0.607000   1.8650   1.6500   0.051222218  -2.220205820
   43   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   44   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   45   3.5000   0.0660   0.175300   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   49   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   50   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   51   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.120000   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   3.5500   0.0760   0.437200   2.0020   1.7750   0.023028004  -0.852763146
   59   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   60   2.5000   0.0500  -0.062100   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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   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    37   317.000  1.510
   33    50   317.000  1.510
   33    55   268.000  1.529
   37    38   549.000  1.340
   37    40   320.000  1.462
   38    39   340.000  1.080
   38    42   425.000  1.378
   42    43   434.000  1.010
   42    45   382.000  1.448
   45    46   340.000  1.090
   45    50   317.000  1.510
   45    51   268.000  1.529
   50    58   465.000  1.376
   58    59   745.000  1.250
   58    60   335.000  1.111
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    54   340.000  1.090
   40    41   570.000  1.229
   40    44   214.000  1.327
   44    47   320.000  1.410
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    55   268.000  1.529
   55    56   340.000  1.090
   55    57   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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    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    37    75.00000  112.20000
   29    33    50    75.00000  112.20000
   29    33    55    75.00000  111.63000
   33    37    38    70.00000  124.00000
   33    37    40    65.00000  116.34900
   33    50    45    65.00000  117.92700
   33    50    58    70.00000  124.00000
   33    55    47    58.35000  112.70000
   33    55    56    37.50000  110.70000
   33    55    57    37.50000  110.70000
   37    38    39    35.00000  120.00000
   37    38    42    70.00000  124.03900
   37    40    41    80.00000  123.72100
   37    40    44    90.00000  111.29400
   38    42    43    35.00000  114.50000
   38    42    45    50.00000  121.00000
   42    38    39    50.00000  112.30800
   42    45    46    35.00000  109.50000
   42    45    50    80.00000  112.42400
   42    45    51    80.00000  111.61500
   45    42    43    35.00000  112.50000
   45    50    58    70.00000  124.00000
   45    51    52    37.50000  110.70000
   45    51    53    37.50000  110.70000
   45    51    54    37.50000  110.70000
   50    33    37    70.00000  110.12100
   50    45    46    35.00000  109.50000
   50    58    59    65.00000  137.10300
   50    58    60    45.00000  105.30000
   60    58    59    50.00000  124.16400
   51    45    46    37.50000  110.70000
   51    45    50    70.00000  112.02700
   53    51    52    33.00000  107.80000
   54    51    52    33.00000  107.80000
   54    51    53    33.00000  107.80000
   40    37    38    65.00000  118.96000
   40    44    47    83.00000  116.90000
   44    40    41    83.00000  123.40000
   44    47    48    35.00000  109.50000
   44    47    49    35.00000  109.50000
   44    47    55    50.00000  109.50000
   47    55    56    37.50000  110.70000
   47    55    57    37.50000  110.70000
   49    47    48    33.00000  107.80000
   55    33    37    70.00000  112.02700
   55    33    50    70.00000  112.02700
   55    47    48    37.50000  110.70000
   55    47    49    37.50000  110.70000
   57    55    56    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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -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    34    35   0.00000  1.0 1.0
   27    30    34    36   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    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   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    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    50  -0.62250  1.0 1.0
   24    29    33    50  -0.38450 -1.0 2.0
   24    29    33    50   0.81900  1.0 3.0
   24    29    33    55   0.01700  1.0 1.0
   24    29    33    55  -0.23550 -1.0 2.0
   24    29    33    55   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    37    38   0.42700  1.0 1.0
   29    33    37    38  -0.70350 -1.0 2.0
   29    33    37    38  -0.43150  1.0 3.0
   29    33    37    40   0.09700  1.0 1.0
   29    33    37    40   0.15600 -1.0 2.0
   29    33    37    40  -0.50800  1.0 3.0
   29    33    50    45   0.30250  1.0 1.0
   29    33    50    45  -0.14950 -1.0 2.0
   29    33    50    45   0.36900  1.0 3.0
   29    33    50    58   0.42700  1.0 1.0
   29    33    50    58  -0.70350 -1.0 2.0
   29    33    50    58  -0.43150  1.0 3.0
   29    33    55    47   0.44750  1.0 1.0
   29    33    55    47  -0.17800 -1.0 2.0
   29    33    55    47   0.20200  1.0 3.0
   29    33    55    56   0.15000  1.0 3.0
   29    33    55    57   0.15000  1.0 3.0
   33    37    38    39   7.00000 -1.0 2.0
   33    37    38    42   7.00000 -1.0 2.0
   33    37    40    41  -0.64400  1.0 1.0
   33    37    40    41   0.26850 -1.0 2.0
   33    37    40    44  -0.15000  1.0 1.0
   33    37    40    44   0.89550 -1.0 2.0
   33    37    40    44  -0.06900  1.0 3.0
   33    50    58    59   7.00000 -1.0 2.0
   33    50    58    60   7.00000 -1.0 2.0
   37    33    50    45   0.09700  1.0 1.0
   37    33    50    45   0.15600 -1.0 2.0
   37    33    50    45  -0.50800  1.0 3.0
   37    33    50    58  -0.28300  1.0 1.0
   37    33    50    58   0.26700 -1.0 2.0
   37    33    50    58  -0.63300  1.0 3.0
   37    33    55    47   0.34400  1.0 1.0
   37    33    55    47   0.09450 -1.0 2.0
   37    33    55    47   0.11100  1.0 3.0
   37    33    55    56   0.15000  1.0 3.0
   37    33    55    57   0.15000  1.0 3.0
   37    38    42    43   1.00000 -1.0 2.0
   37    38   -42    45  -0.54700  1.0 1.0
   37    38   -42    45   1.23000 -1.0 2.0
   37    40   -44    47   2.00000 -1.0 2.0
   38    37    40    41   1.00000 -1.0 2.0
   38    37    40    44  -0.56150  1.0 1.0
   38    37    40    44   2.19150 -1.0 2.0
   38    42    45    46   0.00000  1.0 1.0
   38    42    45    50  -0.12500  1.0 1.0
   38    42    45    50  -0.12500 -1.0 2.0
   38    42    45    50   0.25000  1.0 3.0
   38    42    45    51   0.25450  1.0 1.0
   38    42    45    51  -0.61700 -1.0 2.0
   38    42    45    51  -0.23550  1.0 3.0
   39    38    42    43   1.00000 -1.0 2.0
   39    38    42    45   0.00000  1.0 1.0
   42    45   -50    33   0.09700  1.0 1.0
   42    45   -50    33   0.15600 -1.0 2.0
   42    45   -50    33  -0.50800  1.0 3.0
   42    45    50    58   0.62150  1.0 1.0
   42    45    50    58   0.42850 -1.0 2.0
   42    45    50    58  -0.68200  1.0 3.0
   42    45    51    52   0.22950  1.0 3.0
   42    45    51    53   0.22950  1.0 3.0
   42    45    51    54   0.22950  1.0 3.0
   43    42    45    46   0.00000  1.0 1.0
   43    42    45    50  -0.12500  1.0 1.0
   43    42    45    50  -0.12500 -1.0 2.0
   43    42    45    50   0.25000  1.0 3.0
   43    42    45    51   0.00000  1.0 1.0
   45    50    58    59   7.00000 -1.0 2.0
   45    50    58    60   7.00000 -1.0 2.0
   46    45    50    33   0.34800  1.0 3.0
   46    45    50    58   0.00000  1.0 1.0
   46    45    51    52   0.15000  1.0 3.0
   46    45    51    53   0.15000  1.0 3.0
   46    45    51    54   0.15000  1.0 3.0
   50    33   -37    38  -0.28300  1.0 1.0
   50    33   -37    38   0.26700 -1.0 2.0
   50    33   -37    38  -0.63300  1.0 3.0
   50    33    37    40   0.09700  1.0 1.0
   50    33    37    40   0.15600 -1.0 2.0
   50    33    37    40  -0.50800  1.0 3.0
   50    33    55    47   0.34400  1.0 1.0
   50    33    55    47   0.09450 -1.0 2.0
   50    33    55    47   0.11100  1.0 3.0
   50    33    55    56   0.15000  1.0 3.0
   50    33    55    57   0.15000  1.0 3.0
   50    45    51    52   0.15000  1.0 3.0
   50    45    51    53   0.15000  1.0 3.0
   50    45    51    54   0.15000  1.0 3.0
   51    45    50    33   0.46850  1.0 1.0
   51    45    50    33   0.08550 -1.0 2.0
   51    45    50    33   0.09800  1.0 3.0
   51    45    50    58   0.09850  1.0 1.0
   51    45    50    58   0.15250 -1.0 2.0
   51    45    50    58  -0.50650  1.0 3.0
   40    37    38    39   7.00000 -1.0 2.0
   40    37    38    42   7.00000 -1.0 2.0
   40    44    47    48   0.08050  1.0 3.0
   40    44    47    49   0.08050  1.0 3.0
   40    44    47    55  -0.25900  1.0 1.0
   40    44    47    55  -0.47000 -1.0 2.0
   40    44    47    55   0.11750  1.0 3.0
   41    40    44    47   3.00000 -1.0 2.0
   44    47   -55    33   0.62750  1.0 1.0
   44    47   -55    33  -0.30950 -1.0 2.0
   44    47   -55    33   0.27300  1.0 3.0
   44    47    55    56   0.23400  1.0 3.0
   44    47    55    57   0.23400  1.0 3.0
   48    47    55    33   0.15000  1.0 3.0
   48    47    55    56   0.15000  1.0 3.0
   48    47    55    57   0.15000  1.0 3.0
   49    47    55    33   0.15000  1.0 3.0
   49    47    55    56   0.15000  1.0 3.0
   49    47    55    57   0.15000  1.0 3.0
   55    33    37    38   0.09850  1.0 1.0
   55    33    37    38   0.15250 -1.0 2.0
   55    33    37    38  -0.50650  1.0 3.0
   55    33   -37    40   0.09700  1.0 1.0
   55    33   -37    40   0.15600 -1.0 2.0
   55    33   -37    40  -0.50800  1.0 3.0
   55    33    50    45   0.46850  1.0 1.0
   55    33    50    45   0.08550 -1.0 2.0
   55    33    50    45   0.09800  1.0 3.0
   55    33    50    58   0.09850  1.0 1.0
   55    33    50    58   0.15250 -1.0 2.0
   55    33    50    58  -0.50650  1.0 3.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    34    35  10.50000 -1.0 2.0
   33    40    37    38   1.10000 -1.0 2.0
   42    39    38    37   1.10000 -1.0 2.0
   43    38    42    45   1.00000 -1.0 2.0
   33    45    50    58   1.10000 -1.0 2.0
   59    60    58    50   1.10000 -1.0 2.0
   37    44    40    41  10.50000 -1.0 2.0
END
