* LIGAND DATABASE FILE (OPLS2005)
*
001      56    58    109    182     322
    1     0 S   NP   _N1_     1    28.74909    95.77190   -22.97746
    2     1 S   H    _HN1     2     1.02783   102.66938   -92.06030
    3     1 S   H    _H1_     3     1.02951    76.58016    14.09793
    4     1 S   H    _H2_     4     1.02828    34.82559   164.73892
    5     1 S   CT   _CA1     5     1.50118   138.99771   119.85564
    6     5 S   HC   _HA1     6     1.09573   105.19783    84.74644
    7     5 S   CO3  _C1_     7     1.53790   112.45321   -35.47699
    8     7 S   O2Z  _O11     8     1.26372   115.00535   -42.39447
    9     7 S   O2Z  _O12     9     1.26240   114.95040   136.73022
   10     5 S   CT   _CB1    10     1.53081   107.41752  -157.27618
   11    10 S   HC   HB11    11     1.09832   109.36775   -49.78644
   12    10 S   HC   HB12    12     1.09814   110.44080    66.81573
   13    10 S   CT   _CG1    13     1.52989   112.61793  -170.78096
   14    13 S   HC   HG11    14     1.09583   110.60020   -65.42469
   15    13 S   HC   HG12    15     1.09669   109.81821    53.80992
   16    13 S   C    _CD1    16     1.51799   112.25237   174.24163
   17    16 S   O    _OE1    17     1.22731   123.29341     5.60179
   18    16 S   N    _N2_    18     1.38666   111.65398  -174.48484
   19    18 S   H    _HN2    19     1.01583   118.96631     1.59557
   20    18 S   CT1  _CA2    20     1.46143   123.32174   177.70748
   21    20 S   HC   _HA2    21     1.09739   109.30389     0.55143
   22    20 S   C    _C2_    22     1.53504   108.69583  -114.85704
   23    22 S   O    _O2_    23     1.23057   122.27592  -148.41608
   24    20 S   CT   _CB2    32     1.53264   111.71611   122.48107
   25    24 S   HC   HB21    33     1.09595   110.49739    56.14385
   26    24 S   HC   HB22    34     1.09416   110.11249   174.78203
   27    22 S   N    _N3_    24     1.38328   113.67749    39.03962
   28    27 S   H    _HN3    25     1.01597   119.56241    -3.41088
   29    24 S   S    _SG2    35     1.82692   111.57940   -64.24377
   30    27 S   CT   _CA3    26     1.45287   123.19324   177.04938
   31    30 S   HC   HA31    27     1.09550   107.50476   -64.56076
   32    30 S   HC   HA32    28     1.09557   107.98225    51.86699
   33    29 S   CT   _C6_    36     1.80813    99.29518  -162.48854
   34    33 S   HC   _H3_    37     1.09772   107.33771   -40.26769
   35    30 S   CO3  _C3_    29     1.52956   114.10323   173.86915
   36    35 S   O2Z  _O31    30     1.26375   116.07196    -0.70109
   37    35 S   O2Z  _O32    31     1.26432   114.41222   179.36604
   38    33 S   CM   _C5_    38     1.49937   111.17503  -155.96652
   39    38 S   HC   _H7_    39     1.08232   123.78534    45.10782
   40    38 S   CM   _C4_    40     1.33675   112.93911  -138.67134
   41    40 S   HC   _H6_    41     1.08122   124.12578  -177.36470
   42    40 S   CT   _C8_    42     1.49542   112.12533     2.54607
   43    42 S   HC   _H5_    43     1.09681   109.84761  -111.90765
   44    33 S   CT   _C7_    44     1.54560   118.40266    83.85484
   45    44 S   HC   _H4_    45     1.09931   106.48124  -107.27737
   46    44 S   CT   _C12    46     1.57673   124.98293    20.32453
   47    46 S   Cl   Cl3_    47     1.75448   114.66612   -79.66131
   48    46 S   CM   _C11    48     1.51795   110.22975    54.32789
   49    48 S   Cl   Cl4_    49     1.69502   124.99079  -114.82585
   50    48 S   CM   _C10    50     1.33854   107.57644    68.99073
   51    50 S   Cl   Cl5_    51     1.69346   128.03388   179.42904
   52    42 S   CT   _C9_    52     1.56314   116.78061   118.77465
   53    52 S   Cl   Cl6_    53     1.75305   113.81807    86.73292
   54    46 S   CT   _C13    54     1.57316   101.03482   157.56496
   55    54 S   Cl   Cl1_    55     1.80689   114.70230  -177.08832
   56    54 S   Cl   Cl2_    56     1.79576   115.24212    59.36985
  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   9   5   4   3
  14   7   2   1   1   9   4  10   4  13   7  11   5  10   7   8
   4   6   3   4   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    44    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    42    44    45    46  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    44    45    46    47    48    52    54  
   38    39    40    42    44    45    46  
   36    37  
   37  
    0  
   39    40    41    42    43    44    45    46    52  
   40    41    42    44  
   41    42    43    44    45    46    50    52    53    54  
   42    43    44    52  
   43    44    45    46    47    48    50    51    52    53    54    55    56  
   44    45    46    50    52    53    54  
   45    46    47    48    49    50    52    53    54    55    56  
   46    47    48    52    54  
   47    48    49    50    51    52    53    54    55    56  
   48    49    50    52    54    55    56  
   49    50    51    52    53    54    55    56  
   50    51    52    54  
   51    52    53    54    55    56  
   52    53    54  
   53    54    55    56  
   54    55    56  
   55    56  
   56  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   41   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   47   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   48   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   49   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   50   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   51   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   52   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   53   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   54   3.5000   0.0660   0.271600   1.9750   1.7500   0.005000000  -0.741685710
   55   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   56   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
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    44   268.000  1.529
   38    39   340.000  1.080
   38    40   549.000  1.340
   40    41   340.000  1.080
   40    42   317.000  1.510
   42    43   340.000  1.090
   42    44   268.000  1.529
   42    52   268.000  1.529
   44    45   340.000  1.090
   44    46   268.000  1.529
   46    47   245.000  1.781
   46    48   317.000  1.510
   46    54   268.000  1.529
   48    49   300.000  1.725
   48    50   549.000  1.340
   50    51   300.000  1.725
   50    52   317.000  1.510
   52    53   245.000  1.781
   52    54   268.000  1.529
   54    55   245.000  1.781
   54    56   245.000  1.781
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    44    75.00000  111.63000
   33    38    39    35.00000  117.00000
   33    38    40    70.00000  124.00000
   33    44    42    58.35000  112.70000
   33    44    45    37.50000  110.70000
   33    44    46    58.35000  112.70000
   38    33    34    35.00000  109.50000
   38    40    41    35.00000  120.00000
   38    40    42    70.00000  124.00000
   40    38    39    35.00000  120.00000
   40    42    43    35.00000  109.50000
   40    42    44    70.00000  112.02700
   40    42    52    70.00000  112.02700
   42    40    41    35.00000  117.00000
   42    44    45    37.50000  110.70000
   42    44    46    58.35000  112.70000
   42    52    50    70.00000  112.02700
   42    52    53    69.00000  109.80000
   42    52    54    58.35000  112.70000
   44    33    34    37.50000  110.70000
   44    33    38    70.00000  112.02700
   44    42    43    37.50000  110.70000
   44    46    47    69.00000  109.80000
   44    46    48    70.00000  112.02700
   44    46    54    58.35000  112.70000
   46    44    45    37.50000  110.70000
   46    48    49    75.00000  111.02000
   46    48    50    70.00000  124.00000
   46    54    52    58.35000  112.70000
   46    54    55    69.00000  109.80000
   46    54    56    69.00000  109.80000
   48    46    47    75.00000  111.90500
   48    50    51    75.00000  121.50000
   48    50    52    70.00000  124.00000
   50    48    49    75.00000  121.50000
   50    52    53    75.00000  111.90500
   50    52    54    70.00000  112.02700
   52    42    43    37.50000  110.70000
   52    42    44    58.35000  112.70000
   52    50    51    75.00000  111.02000
   52    54    55    69.00000  109.80000
   52    54    56    69.00000  109.80000
   54    46    47    69.00000  109.80000
   54    46    48    70.00000  112.02700
   54    52    53    69.00000  109.80000
   56    54    55    80.00000  110.42200
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    44   0.01700  1.0 1.0
   24    29    33    44  -0.23550 -1.0 2.0
   24    29    33    44   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    38    39   0.00000  1.0 1.0
   29    33    38    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    44    42   0.44750  1.0 1.0
   29    33    44    42  -0.17800 -1.0 2.0
   29    33    44    42   0.20200  1.0 3.0
   29    33    44    45   0.15000  1.0 3.0
   29    33    44    46   0.44750  1.0 1.0
   29    33    44    46  -0.17800 -1.0 2.0
   29    33    44    46   0.20200  1.0 3.0
   33    38    40    41   7.00000 -1.0 2.0
   33    38   -40    42   7.00000 -1.0 2.0
   33    44    46    47   0.35600  1.0 1.0
   33    44    46    47  -0.14650 -1.0 2.0
   33    44    46    47   0.33350  1.0 3.0
   33    44    46    48   0.34400  1.0 1.0
   33    44    46    48   0.09450 -1.0 2.0
   33    44    46    48   0.11100  1.0 3.0
   33    44    46    54   0.56750  1.0 1.0
   33    44    46    54  -0.07550 -1.0 2.0
   33    44    46    54   0.20000  1.0 3.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    44    42   0.15000  1.0 3.0
   34    33    44    45   0.15000  1.0 3.0
   34    33    44    46   0.15000  1.0 3.0
   38    33   -44    42   0.34400  1.0 1.0
   38    33   -44    42   0.09450 -1.0 2.0
   38    33   -44    42   0.11100  1.0 3.0
   38    33    44    45   0.15000  1.0 3.0
   38    33    44    46   0.34400  1.0 1.0
   38    33    44    46   0.09450 -1.0 2.0
   38    33    44    46   0.11100  1.0 3.0
   38    40    42    43   0.00000  1.0 1.0
   38    40   -42    44   0.09850  1.0 1.0
   38    40   -42    44   0.15250 -1.0 2.0
   38    40   -42    44  -0.50650  1.0 3.0
   38    40    42    52   0.09850  1.0 1.0
   38    40    42    52   0.15250 -1.0 2.0
   38    40    42    52  -0.50650  1.0 3.0
   39    38    40    41   7.00000 -1.0 2.0
   39    38    40    42   7.00000 -1.0 2.0
   40    42   -44    33   0.34400  1.0 1.0
   40    42   -44    33   0.09450 -1.0 2.0
   40    42   -44    33   0.11100  1.0 3.0
   40    42    44    45   0.15000  1.0 3.0
   40    42    44    46   0.34400  1.0 1.0
   40    42    44    46   0.09450 -1.0 2.0
   40    42    44    46   0.11100  1.0 3.0
   40    42    52    50   0.31000  1.0 1.0
   40    42    52    50   0.14700 -1.0 2.0
   40    42    52    50   0.07550  1.0 3.0
   40    42    52    53   0.56750  1.0 1.0
   40    42    52    53  -0.07550 -1.0 2.0
   40    42    52    53   0.20000  1.0 3.0
   40    42    52    54   0.34400  1.0 1.0
   40    42    52    54   0.09450 -1.0 2.0
   40    42    52    54   0.11100  1.0 3.0
   41    40    42    43   0.33100  1.0 3.0
   41    40    42    44   0.00000  1.0 1.0
   41    40    42    52   0.00000  1.0 1.0
   42    44    46    47   0.35600  1.0 1.0
   42    44    46    47  -0.14650 -1.0 2.0
   42    44    46    47   0.33350  1.0 3.0
   42    44    46    48   0.34400  1.0 1.0
   42    44    46    48   0.09450 -1.0 2.0
   42    44    46    48   0.11100  1.0 3.0
   42    44   -46    54   0.56750  1.0 1.0
   42    44   -46    54  -0.07550 -1.0 2.0
   42    44   -46    54   0.20000  1.0 3.0
   42    52   -54    46   0.56750  1.0 1.0
   42    52   -54    46  -0.07550 -1.0 2.0
   42    52   -54    46   0.20000  1.0 3.0
   42    52    54    55   0.35600  1.0 1.0
   42    52    54    55  -0.14650 -1.0 2.0
   42    52    54    55   0.33350  1.0 3.0
   42    52    54    56   0.35600  1.0 1.0
   42    52    54    56  -0.14650 -1.0 2.0
   42    52    54    56   0.33350  1.0 3.0
   43    42    44    33   0.15000  1.0 3.0
   43    42    44    45   0.15000  1.0 3.0
   43    42    44    46   0.15000  1.0 3.0
   43    42    52    50   0.15000  1.0 3.0
   43    42    52    53   0.27000  1.0 3.0
   43    42    52    54   0.15000  1.0 3.0
   44    33    38    39   0.00000  1.0 1.0
   44    33   -38    40   0.09850  1.0 1.0
   44    33   -38    40   0.15250 -1.0 2.0
   44    33   -38    40  -0.50650  1.0 3.0
   44    42    52    50   0.34400  1.0 1.0
   44    42    52    50   0.09450 -1.0 2.0
   44    42    52    50   0.11100  1.0 3.0
   44    42    52    53   0.35600  1.0 1.0
   44    42    52    53  -0.14650 -1.0 2.0
   44    42    52    53   0.33350  1.0 3.0
   44    42   -52    54   0.56750  1.0 1.0
   44    42   -52    54  -0.07550 -1.0 2.0
   44    42   -52    54   0.20000  1.0 3.0
   44    46    48    49   0.09700  1.0 1.0
   44    46    48    49   0.15600 -1.0 2.0
   44    46    48    49  -0.50800  1.0 3.0
   44    46   -48    50   0.09850  1.0 1.0
   44    46   -48    50   0.15250 -1.0 2.0
   44    46   -48    50  -0.50650  1.0 3.0
   44    46   -54    52   0.56750  1.0 1.0
   44    46   -54    52  -0.07550 -1.0 2.0
   44    46   -54    52   0.20000  1.0 3.0
   44    46    54    55   0.35600  1.0 1.0
   44    46    54    55  -0.14650 -1.0 2.0
   44    46    54    55   0.33350  1.0 3.0
   44    46    54    56   0.35600  1.0 1.0
   44    46    54    56  -0.14650 -1.0 2.0
   44    46    54    56   0.33350  1.0 3.0
   45    44    46    47   0.27000  1.0 3.0
   45    44    46    48   0.15000  1.0 3.0
   45    44    46    54   0.15000  1.0 3.0
   46    48    50    51   7.00000 -1.0 2.0
   46    48   -50    52   7.00000 -1.0 2.0
   47    46    48    49   0.09700  1.0 1.0
   47    46    48    49   0.15600 -1.0 2.0
   47    46    48    49  -0.50800  1.0 3.0
   47    46    48    50   0.09700  1.0 1.0
   47    46    48    50   0.15600 -1.0 2.0
   47    46    48    50  -0.50800  1.0 3.0
   47    46    54    52   0.35600  1.0 1.0
   47    46    54    52  -0.14650 -1.0 2.0
   47    46    54    52   0.33350  1.0 3.0
   47    46    54    55   0.22500  1.0 1.0
   47    46    54    56   0.22500  1.0 1.0
   48    46   -54    52   0.34400  1.0 1.0
   48    46   -54    52   0.09450 -1.0 2.0
   48    46   -54    52   0.11100  1.0 3.0
   48    46    54    55   0.56750  1.0 1.0
   48    46    54    55  -0.07550 -1.0 2.0
   48    46    54    55   0.20000  1.0 3.0
   48    46    54    56   0.56750  1.0 1.0
   48    46    54    56  -0.07550 -1.0 2.0
   48    46    54    56   0.20000  1.0 3.0
   48    50   -52    42   0.09850  1.0 1.0
   48    50   -52    42   0.15250 -1.0 2.0
   48    50   -52    42  -0.50650  1.0 3.0
   48    50    52    53   0.09700  1.0 1.0
   48    50    52    53   0.15600 -1.0 2.0
   48    50    52    53  -0.50800  1.0 3.0
   48    50   -52    54   0.09850  1.0 1.0
   48    50   -52    54   0.15250 -1.0 2.0
   48    50   -52    54  -0.50650  1.0 3.0
   49    48    50    51   7.00000 -1.0 2.0
   49    48    50    52   7.00000 -1.0 2.0
   50    52   -54    46   0.34400  1.0 1.0
   50    52   -54    46   0.09450 -1.0 2.0
   50    52   -54    46   0.11100  1.0 3.0
   50    52    54    55   0.56750  1.0 1.0
   50    52    54    55  -0.07550 -1.0 2.0
   50    52    54    55   0.20000  1.0 3.0
   50    52    54    56   0.56750  1.0 1.0
   50    52    54    56  -0.07550 -1.0 2.0
   50    52    54    56   0.20000  1.0 3.0
   51    50    52    42   0.09700  1.0 1.0
   51    50    52    42   0.15600 -1.0 2.0
   51    50    52    42  -0.50800  1.0 3.0
   51    50    52    53   0.09700  1.0 1.0
   51    50    52    53   0.15600 -1.0 2.0
   51    50    52    53  -0.50800  1.0 3.0
   51    50    52    54   0.09700  1.0 1.0
   51    50    52    54   0.15600 -1.0 2.0
   51    50    52    54  -0.50800  1.0 3.0
   52    42    44    33   0.56750  1.0 1.0
   52    42    44    33  -0.07550 -1.0 2.0
   52    42    44    33   0.20000  1.0 3.0
   52    42    44    45   0.15000  1.0 3.0
   52    42   -44    46   0.56750  1.0 1.0
   52    42   -44    46  -0.07550 -1.0 2.0
   52    42   -44    46   0.20000  1.0 3.0
   53    52    54    46   0.35600  1.0 1.0
   53    52    54    46  -0.14650 -1.0 2.0
   53    52    54    46   0.33350  1.0 3.0
   53    52    54    55   0.22500  1.0 1.0
   53    52    54    56   0.22500  1.0 1.0
   54    46    48    49   0.09700  1.0 1.0
   54    46    48    49   0.15600 -1.0 2.0
   54    46    48    49  -0.50800  1.0 3.0
   54    46   -48    50   0.09850  1.0 1.0
   54    46   -48    50   0.15250 -1.0 2.0
   54    46   -48    50  -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    39    38    40   1.10000 -1.0 2.0
   42    41    40    38   1.10000 -1.0 2.0
   46    49    48    50   1.10000 -1.0 2.0
   52    51    50    48   1.10000 -1.0 2.0
END
