* LIGAND DATABASE FILE (OPLS2005)
*
001      54    55     99    157     293
    1     0 S   NP   _N1_     1    27.99116    95.15593   -23.18772
    2     1 S   H    _HN1     2     1.02957    85.71771    -4.28907
    3     1 S   H    _H1_     3     1.02835    25.79622   141.86698
    4     1 S   H    _H2_     4     1.02776   102.18873  -112.14588
    5     1 S   CT   _CA1     5     1.50137   133.65296   110.00223
    6     5 S   HC   _HA1     6     1.09576   105.19954    73.39729
    7     5 S   CO3  _C1_     7     1.53769   112.36107   -46.76453
    8     7 S   O2Z  _O11     8     1.26366   114.98977   -43.78043
    9     7 S   O2Z  _O12     9     1.26232   114.92308   135.25120
   10     5 S   CT   _CB1    10     1.53088   107.41559  -168.71430
   11    10 S   HC   HB11    11     1.09829   109.28100   -50.51427
   12    10 S   HC   HB12    12     1.09815   110.44602    66.02152
   13    10 S   CT   _CG1    13     1.53034   112.70843  -171.58245
   14    13 S   HC   HG11    14     1.09591   110.52287   -65.38949
   15    13 S   HC   HG12    15     1.09660   109.89073    53.82757
   16    13 S   C    _CD1    16     1.51850   112.26115   174.16434
   17    16 S   O    _OE1    17     1.22761   123.27129     2.15894
   18    16 S   N    _N2_    18     1.38578   111.77866  -177.82976
   19    18 S   H    _HN2    19     1.01562   119.02117     4.10332
   20    18 S   CT1  _CA2    20     1.45811   122.77526   177.23487
   21    20 S   HC   _HA2    21     1.09732   108.94317    24.44202
   22    20 S   C    _C2_    22     1.52959   107.02478   -92.55732
   23    22 S   O    _O2_    23     1.22970   123.06675   -26.36341
   24    20 S   CT   _CB2    32     1.53251   112.31151   147.67725
   25    24 S   HC   HB21    33     1.09458   109.94109    54.76702
   26    24 S   HC   HB22    34     1.09460   109.67061   173.29022
   27    22 S   N    _N3_    24     1.38489   112.52179   156.45185
   28    27 S   H    _HN3    25     1.01653   120.35035    -2.36231
   29    24 S   S    _SG2    35     1.82965   110.94118   -66.83033
   30    27 S   CT   _CA3    26     1.45357   122.54453   178.46813
   31    30 S   HC   HA31    27     1.09565   107.88865   -54.34465
   32    30 S   HC   HA32    28     1.09559   107.55647    62.02117
   33    29 S   CT   _C8_    36     1.85108   101.07369   174.40770
   34    30 S   CO3  _C3_    29     1.52902   114.26025  -176.25917
   35    34 S   O2Z  _O31    30     1.26345   116.03034     0.90482
   36    34 S   O2Z  _O32    31     1.26429   114.42519  -179.16023
   37    33 S   CM   _C7_    37     1.50611   109.61359    58.79013
   38    37 S   HC   _H8_    38     1.08808   118.27845    55.34818
   39    33 S   CM   _C11    51     1.49046   107.24849  -178.99458
   40    39 S   HC   _H9_    52     1.08401   123.30971   -73.65320
   41    37 S   CM   _C6_    39     1.34147   123.23364  -122.38153
   42    41 S   HC   _H7_    40     1.08642   119.22136   176.67169
   43    41 S   CT   _C5_    41     1.49684   122.53902    -3.30932
   44    43 S   HC   _H3_    42     1.09574   109.13686    97.57451
   45    43 S   CT   _C4_    43     1.52611   111.46777   -25.39336
   46    45 S   HC   _H5_    44     1.09793   110.17645   173.38144
   47    45 S   HC   _H6_    45     1.09969   109.95468   -72.75046
   48    43 S   OH   _O35    53     1.42435   108.39998  -145.30390
   49    48 S   HO   _H10    54     0.97235   107.50434   178.58142
   50    33 S   CT   _C9_    46     1.53814   112.35963   -70.93177
   51    50 S   HC   _H4_    47     1.09571   112.73406    24.12275
   52    50 S   OS   _O33    48     1.44498   107.28165   -93.59110
   53    52 S   CMA  _C10    49     1.42080   106.50166   -20.78896
   54    53 S   OM   _O34    50     1.26148   123.20852  -167.88918
  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
  15   2   1   1  13   5   8   4   9   4   9   6   8   5   4   2
   1   4   2   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    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    45    50    51    52    53    39    40  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    43    45    46    47    50    51    52    53    54    39    40  
   35    36  
   36  
    0  
   38    41    42    43    44    45    50    51    52    53    39    40    48  
   41    42    43    50    39  
   40    41    45    50    51    52    53    54  
   50    52    53    54  
   42    43    44    45    46    47    50    48    49  
   43    44    45    48  
   44    45    46    47    50    51    52    48    49  
   45    46    47    50    48    49  
   46    47    50    51    52    53    48    49  
   47    50    51    52    48  
   50    51    52    48  
   49    50  
    0  
   51    52    53    54  
   52    53  
   53    54  
   54  
    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  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   40   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   42   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   49   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   50   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   52   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   53   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   54   3.1500   0.2500  -0.373900   1.7825   1.5750   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    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   268.000  1.529
   33    39   317.000  1.510
   37    38   340.000  1.080
   37    41   549.000  1.340
   41    42   340.000  1.080
   41    43   317.000  1.510
   43    44   340.000  1.090
   43    45   268.000  1.529
   43    48   320.000  1.410
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    50   268.000  1.529
   50    51   340.000  1.090
   50    52   320.000  1.410
   52    53   440.000  1.360
   53    54   745.000  1.250
   53    39   465.000  1.376
   39    40   340.000  1.080
   48    49   553.000  0.945
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  111.63000
   29    33    39    75.00000  112.20000
   33    37    38    35.00000  117.00000
   33    37    41    70.00000  124.00000
   33    50    45    58.35000  112.70000
   33    50    51    37.50000  110.70000
   33    50    52    50.00000  109.50000
   33    39    53    70.00000  124.00000
   33    39    40    35.00000  117.00000
   37    41    42    35.00000  120.00000
   37    41    43    70.00000  124.00000
   41    37    38    35.00000  120.00000
   41    43    44    35.00000  109.50000
   41    43    45    70.00000  112.02700
   41    43    48    90.00000  110.39200
   43    41    42    35.00000  117.00000
   43    45    46    37.50000  110.70000
   43    45    47    37.50000  110.70000
   43    45    50    58.35000  112.70000
   43    48    49    55.00000  108.50000
   45    43    44    37.50000  110.70000
   45    50    51    37.50000  110.70000
   45    50    52    50.00000  109.50000
   47    45    46    33.00000  107.80000
   50    33    37    70.00000  112.02700
   50    45    46    37.50000  110.70000
   50    45    47    37.50000  110.70000
   50    52    53    90.00000  111.18400
   52    50    51    35.00000  109.50000
   52    53    54    65.00000  121.00000
   52    53    39    80.00000  120.01400
   53    39    40    40.00000  120.50800
   39    33    37    70.00000  110.12100
   39    33    50    70.00000  112.02700
   39    53    54    65.00000  137.10300
   48    43    44    35.00000  109.50000
   48    43    45    50.00000  109.50000
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   0.01700  1.0 1.0
   24    29    33    50  -0.23550 -1.0 2.0
   24    29    33    50   0.21350  1.0 3.0
   24    29    33    39  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   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    37    38   0.00000  1.0 1.0
   29    33    37    41   0.42700  1.0 1.0
   29    33    37    41  -0.70350 -1.0 2.0
   29    33    37    41  -0.43150  1.0 3.0
   29    33    50    45   0.44750  1.0 1.0
   29    33    50    45  -0.17800 -1.0 2.0
   29    33    50    45   0.20200  1.0 3.0
   29    33    50    51   0.15000  1.0 3.0
   29    33    50    52   0.56750  1.0 1.0
   29    33    50    52  -0.07550 -1.0 2.0
   29    33    50    52   0.20000  1.0 3.0
   29    33    39    53   0.42700  1.0 1.0
   29    33    39    53  -0.70350 -1.0 2.0
   29    33    39    53  -0.43150  1.0 3.0
   29    33    39    40   0.00000  1.0 1.0
   33    37    41    42   7.00000 -1.0 2.0
   33    37    41    43   7.00000 -1.0 2.0
   33    50   -52    53  -0.46850  1.0 1.0
   33    50   -52    53   0.09300 -1.0 2.0
   33    50   -52    53  -0.12850  1.0 3.0
   37    33    50    45   0.34400  1.0 1.0
   37    33    50    45   0.09450 -1.0 2.0
   37    33    50    45   0.11100  1.0 3.0
   37    33    50    51   0.15000  1.0 3.0
   37    33    50    52   0.61850  1.0 1.0
   37    33    50    52  -0.22750 -1.0 2.0
   37    33    50    52   0.15300  1.0 3.0
   37    33    39    53  -0.28300  1.0 1.0
   37    33    39    53   0.26700 -1.0 2.0
   37    33    39    53  -0.63300  1.0 3.0
   37    33    39    40   0.00000  1.0 1.0
   37    41    43    44   0.00000  1.0 1.0
   37    41   -43    45   0.09850  1.0 1.0
   37    41   -43    45   0.15250 -1.0 2.0
   37    41   -43    45  -0.50650  1.0 3.0
   37    41    43    48   0.67800  1.0 1.0
   37    41    43    48   0.47050 -1.0 2.0
   37    41    43    48  -0.62500  1.0 3.0
   38    37    41    42   7.00000 -1.0 2.0
   38    37    41    43   7.00000 -1.0 2.0
   41    43    45    46   0.15000  1.0 3.0
   41    43    45    47   0.15000  1.0 3.0
   41    43    45    50   0.34400  1.0 1.0
   41    43    45    50   0.09450 -1.0 2.0
   41    43    45    50   0.11100  1.0 3.0
   41    43    48    49  -0.07800  1.0 1.0
   41    43    48    49  -0.21500 -1.0 2.0
   41    43    48    49  -0.03150  1.0 3.0
   42    41    43    44   0.33100  1.0 3.0
   42    41    43    45   0.00000  1.0 1.0
   42    41    43    48   0.00000  1.0 1.0
   43    45   -50    33   0.56750  1.0 1.0
   43    45   -50    33  -0.07550 -1.0 2.0
   43    45   -50    33   0.20000  1.0 3.0
   43    45    50    51   0.15000  1.0 3.0
   43    45    50    52   0.62750  1.0 1.0
   43    45    50    52  -0.30950 -1.0 2.0
   43    45    50    52   0.27300  1.0 3.0
   44    43    45    46   0.15000  1.0 3.0
   44    43    45    47   0.15000  1.0 3.0
   44    43    45    50   0.15000  1.0 3.0
   44    43    48    49   0.19450  1.0 3.0
   45    43    48    49  -0.11600  1.0 1.0
   45    43    48    49  -0.09450 -1.0 2.0
   45    43    48    49   0.21250  1.0 3.0
   45    50    52    53  -0.46850  1.0 1.0
   45    50    52    53   0.09300 -1.0 2.0
   45    50    52    53  -0.12850  1.0 3.0
   46    45    50    33   0.15000  1.0 3.0
   46    45    50    51   0.15000  1.0 3.0
   46    45    50    52   0.23400  1.0 3.0
   47    45    50    33   0.15000  1.0 3.0
   47    45    50    51   0.15000  1.0 3.0
   47    45    50    52   0.23400  1.0 3.0
   50    33    37    38   0.00000  1.0 1.0
   50    33   -37    41   0.09850  1.0 1.0
   50    33   -37    41   0.15250 -1.0 2.0
   50    33   -37    41  -0.50650  1.0 3.0
   50    33   -39    53   0.09850  1.0 1.0
   50    33   -39    53   0.15250 -1.0 2.0
   50    33   -39    53  -0.50650  1.0 3.0
   50    33    39    40   0.00000  1.0 1.0
   50    52    53    54   2.00000 -1.0 2.0
   50    52   -53    39  -2.26850  1.0 1.0
   50    52   -53    39   3.39050 -1.0 2.0
   51    50    52    53   0.08050  1.0 3.0
   52    53   -39    33   7.00000 -1.0 2.0
   52    53    39    40   7.00000 -1.0 2.0
   54    53    39    33   7.00000 -1.0 2.0
   54    53    39    40   7.00000 -1.0 2.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    41  -0.28300  1.0 1.0
   39    33    37    41   0.26700 -1.0 2.0
   39    33    37    41  -0.63300  1.0 3.0
   39    33    50    45   0.34400  1.0 1.0
   39    33    50    45   0.09450 -1.0 2.0
   39    33    50    45   0.11100  1.0 3.0
   39    33    50    51   0.15000  1.0 3.0
   39    33   -50    52   0.61850  1.0 1.0
   39    33   -50    52  -0.22750 -1.0 2.0
   39    33   -50    52   0.15300  1.0 3.0
   48    43    45    46   0.23400  1.0 3.0
   48    43    45    47   0.23400  1.0 3.0
   48    43    45    50   0.86500  1.0 1.0
   48    43    45    50  -0.17500 -1.0 2.0
   48    43    45    50   0.20800  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
   35    30    34    36  10.50000 -1.0 2.0
   33    38    37    41   1.10000 -1.0 2.0
   43    42    41    37   1.10000 -1.0 2.0
   52    54    53    39   1.10000 -1.0 2.0
   33    40    39    53   1.10000 -1.0 2.0
END
