* LIGAND DATABASE FILE (OPLS2005)
*
001      60    61    110    170     323
    1     0 S   NP   _N1_     1    28.85651    95.03424   -20.35981
    2     1 S   H    _HN1     2     1.02839    35.13909   149.71950
    3     1 S   H    _H1_     3     1.02781    83.09487   -75.11063
    4     1 S   H    _H2_     4     1.02961    92.47750    33.03332
    5     1 S   CT   _CA1     5     1.50119   145.15754   165.36935
    6     5 S   HC   _HA1     6     1.09573   105.25804    49.67859
    7     5 S   CO3  _C1_     7     1.53832   112.26418   -70.58007
    8     7 S   O2Z  _O11     8     1.26360   115.02217   -46.26655
    9     7 S   O2Z  _O12     9     1.26235   114.90963   132.81345
   10     5 S   CT   _CB1    10     1.53083   107.42055   167.58368
   11    10 S   HC   HB11    11     1.09819   109.43830   -50.29873
   12    10 S   HC   HB12    12     1.09826   110.39338    66.28427
   13    10 S   CT   _CG1    13     1.52997   112.62262  -171.41874
   14    13 S   HC   HG11    14     1.09529   110.32943   -60.19048
   15    13 S   HC   HG12    15     1.09630   110.14833    58.89282
   16    13 S   C    _CD1    16     1.51808   112.12584   179.02662
   17    16 S   O    _OE1    17     1.22742   123.12981   -12.30267
   18    16 S   N    _N2_    18     1.38567   111.75168   168.48749
   19    18 S   H    _HN2    19     1.01595   119.13238     0.52526
   20    18 S   CT1  _CA2    20     1.46279   123.45323  -178.54626
   21    20 S   HC   _HA2    21     1.09738   109.33755   -11.64163
   22    20 S   C    _C2_    22     1.53476   108.72271  -127.27853
   23    22 S   O    _O2_    23     1.23028   122.19599  -149.37763
   24    20 S   CT   _CB2    32     1.53557   111.14840   110.35856
   25    24 S   HC   HB21    33     1.09213   109.00486    54.32688
   26    24 S   HC   HB22    34     1.09431   110.28176   173.18695
   27    22 S   N    _N3_    24     1.38506   113.48235    38.32179
   28    27 S   H    _HN3    25     1.01517   118.85921    -0.90287
   29    24 S   S    _SG2    35     1.82795   111.13414   -67.30746
   30    27 S   CT   _CA3    26     1.45445   123.52211   175.05308
   31    30 S   HC   HA31    27     1.09519   109.30849    22.97707
   32    30 S   HC   HA32    28     1.09497   107.10136   139.98839
   33    29 S   CT   _C12    36     1.88440   102.08258   163.78249
   34    30 S   CO3  _C3_    29     1.52916   113.08240  -100.55547
   35    34 S   O2Z  _O31    30     1.26407   115.40108   -44.57787
   36    34 S   O2Z  _O32    31     1.26356   114.99461   136.37104
   37    33 S   CM   _C5_    37     1.52346   105.07781   170.49736
   38    37 S   CM   _C4_    38     1.34215   121.21138    99.99505
   39    38 S   HC   _H16    39     1.08444   123.52656   179.03409
   40    37 S   CO4  _C6_    52     1.48153   122.62777   -82.12161
   41    40 S   O    _O13    53     1.22759   122.41469   168.01028
   42    38 S   NE   _N11    40     1.36477   124.21856    -0.69942
   43    42 S   H    _H26    41     1.01491   117.15312  -177.41404
   44    40 S   OS   _O14    54     1.35337   117.03073   -13.31100
   45    42 S   CT   _C11    42     1.45069   124.49399    -1.26300
   46    45 S   HC   _H22    43     1.09785   105.93631   138.51737
   47    44 S   CT   _C10    55     1.43624   124.13988     7.56787
   48    47 S   HC   _H20    56     1.09547   106.94498  -147.40911
   49    47 S   HC   _H21    57     1.09462   107.90477    98.29361
   50    33 S   CM   _C7_    44     1.56498   108.10978   -70.91542
   51    45 S   CT   _C13    48     1.52745   109.85865  -106.56444
   52    51 S   HC   _H23    49     1.09378   112.59941    52.41579
   53    51 S   HC   _H24    50     1.09635   110.09054   -66.08201
   54    51 S   HC   _H25    51     1.09486   111.23478   174.63842
   55    33 S   CT   _C9_    58     1.53928   111.07163    56.61384
   56    55 S   HC   _H18    59     1.09411   112.73613   -61.35498
   57    55 S   HC   _H19    60     1.09964   108.84895  -179.66196
   58    50 S   CMA  _C8_    45     1.36102   126.26590   105.92474
   59    58 S   OM   _O33    46     1.25868   134.92240    -2.26278
   60    58 S   HC   _H17    47     1.09275   112.05826   178.41267
  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
