* LIGAND DATABASE FILE (OPLS2005)
*
001      58    60    115    191     341
    1     0 S   NP   _N1_     1    29.19318    94.61894   -19.50986
    2     1 S   H    _HN1     2     1.02833    35.38984   144.37516
    3     1 S   H    _H1_     3     1.02771    78.97586   -70.92818
    4     1 S   H    _H2_     4     1.02964    98.08016    36.32770
    5     1 S   CT   _CA1     5     1.50144   142.85507   176.55707
    6     5 S   HC   _HA1     6     1.09573   105.21515    39.83792
    7     5 S   CO3  _C1_     7     1.53847   112.42722   -80.28819
    8     7 S   O2Z  _O11     8     1.26355   114.99460   -40.51480
    9     7 S   O2Z  _O12     9     1.26249   114.93911   138.56931
   10     5 S   CT   _CB1    10     1.53096   107.40139   157.76798
   11    10 S   HC   HB11    11     1.09817   109.37929   -50.08693
   12    10 S   HC   HB12    12     1.09805   110.36076    66.43176
   13    10 S   CT   _CG1    13     1.52967   112.67738  -171.20123
   14    13 S   HC   HG11    14     1.09549   110.41554   -61.32777
   15    13 S   HC   HG12    15     1.09643   110.08165    57.66797
   16    13 S   C    _CD1    16     1.51843   112.31788   177.70655
   17    16 S   O    _OE1    17     1.22702   123.25441   -12.64690
   18    16 S   N    _N2_    18     1.38516   111.55834   168.45805
   19    18 S   H    _HN2    19     1.01605   118.87086     0.02798
   20    18 S   CT1  _CA2    20     1.46284   123.75895   179.95577
   21    20 S   HC   _HA2    21     1.09722   109.49437   -16.31765
   22    20 S   C    _C2_    22     1.53493   107.79702  -131.86827
   23    22 S   O    _O2_    23     1.22991   122.42488  -144.94512
   24    20 S   CT   _CB2    32     1.53437   110.99811   106.33305
   25    24 S   HC   HB21    33     1.09221   108.68790    50.40621
   26    24 S   HC   HB22    34     1.09489   110.84372   168.19109
   27    22 S   N    _N3_    24     1.38564   113.25867    42.40077
   28    27 S   H    _HN3    25     1.01528   118.89331    -0.47395
   29    24 S   S    _SG2    35     1.83045   111.55724   -73.48800
   30    27 S   CT   _CA3    26     1.45441   123.42214   175.12705
   31    30 S   HC   HA31    27     1.09525   109.19709    25.04923
   32    30 S   HC   HA32    28     1.09493   107.12447   142.05961
   33    29 S   CT   _C7_    36     1.85269   102.90822   136.40919
   34    33 S   Cl   Cl1_    37     1.83452   106.09973   173.71519
   35    30 S   CO3  _C3_    29     1.52931   113.17230   -98.39391
   36    35 S   O2Z  _O31    30     1.26401   115.44473   -43.06333
   37    35 S   O2Z  _O32    31     1.26361   114.95689   137.88519
   38    33 S   CT   _C8_    38     1.57927   115.54760    48.91779
   39    38 S   OM   _O33    39     1.32020   112.97408    77.66375
   40    38 S   HC   _H6_    40     1.09280   106.60143   -52.94155
   41    38 S   CT   _C4_    41     1.55922   102.26103  -164.86869
   42    41 S   HC   _H3_    42     1.10123   110.82728   -90.31128
   43    41 S   CT   _C5_    43     1.57710   106.05409    26.54177
   44    43 S   HC   _H4_    44     1.09882   108.28181  -117.47020
   45    33 S   CT   _C6_    45     1.55420   112.47033   -66.67219
   46    45 S   Cl   Cl2_    46     1.78035   115.99978   -69.04735
   47    45 S   HC   _H5_    47     1.09059   109.95384    49.34579
   48    43 S   CT   _C9_    48     1.56298   102.77842   125.82446
   49    48 S   Cl   Cl8_    49     1.75133   114.05409   161.82024
   50    48 S   CM   _C10    50     1.51671   108.70885   -66.43586
   51    50 S   Cl   Cl7_    51     1.69443   124.54470  -109.27052
   52    50 S   CM   _C11    52     1.33870   107.54548    69.86869
   53    52 S   Cl   Cl6_    53     1.69421   127.83858  -179.46186
   54    41 S   CT   _C12    54     1.57060   119.35027   140.97343
   55    54 S   Cl   Cl5_    55     1.75205   114.22860    81.78669
   56    48 S   CT   _C13    56     1.56693   101.70873    37.01696
   57    56 S   Cl   Cl3_    57     1.80672   114.46862  -176.01867
   58    56 S   Cl   Cl4_    58     1.79482   114.86511    60.94305
  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  10   5   4   3
  13   8   2   1   1  14   6   5  16   8  14   8   7   2   1  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    45    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    43    45    46    47  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    44    45    46    47    48    54  
   38    39    40    41    43    45    46    47  
   36    37  
   37  
    0  
   39    40    41    42    43    44    45    46    47    48    52    54    55    56  
   40    41    42    43    45    54  
   41    42    43    45    54  
   42    43    44    45    46    47    48    49    50    52    53    54    55    56    57    58  
   43    44    45    48    52    54    55    56  
   44    45    46    47    48    49    50    51    52    54    55    56    57    58  
   45    46    47    48    49    50    54    56  
   46    47    48    49    50    54    56  
   47    48  
   48  
   49    50    51    52    53    54    55    56    57    58  
   50    51    52    54    56    57    58  
   51    52    53    54    55    56    57    58  
   52    53    54    56  
   53    54    55    56    57    58  
   54    55    56  
   55    56    57    58  
   56    57    58  
   57    58  
   58  
    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  -0.175000   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   0.207500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   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   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   39   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   40   2.5000   0.0500   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660  -0.060000   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   0.097000   1.9750   1.7500   0.005000000  -0.741685710
   46   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   47   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   49   3.4000   0.3000  -0.200000   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   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   53   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   54   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   55   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   56   3.5000   0.0660   0.271600   1.9750   1.7500   0.005000000  -0.741685710
   57   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   58   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   245.000  1.781
   33    38   268.000  1.529
   33    45   268.000  1.529
   38    39   570.000  1.307
   38    40   340.000  1.090
   38    41   268.000  1.529
   41    42   340.000  1.090
   41    43   268.000  1.529
   41    54   268.000  1.529
   43    44   340.000  1.090
   43    45   268.000  1.529
   43    48   268.000  1.529
   45    46   245.000  1.781
   45    47   340.000  1.090
   48    49   245.000  1.781
   48    50   317.000  1.510
   48    56   268.000  1.529
   50    51   300.000  1.725
   50    52   549.000  1.340
   52    53   300.000  1.725
   52    54   317.000  1.510
   54    55   245.000  1.781
   54    56   268.000  1.529
   56    57   245.000  1.781
   56    58   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    85.00000  110.65400
   29    33    38    75.00000  111.63000
   29    33    45    75.00000  111.63000
   33    38    39    50.00000  109.50000
   33    38    40    37.50000  110.70000
   33    38    41    58.35000  112.70000
   33    45    43    58.35000  112.70000
   33    45    46    69.00000  109.80000
   33    45    47    37.50000  110.70000
   38    33    34    69.00000  109.80000
   38    41    42    37.50000  110.70000
   38    41    43    58.35000  112.70000
   38    41    54    58.35000  112.70000
   40    38    39    45.00000  125.66300
   41    38    39    50.00000  109.50000
   41    38    40    37.50000  110.70000
   41    43    44    37.50000  110.70000
   41    43    45    58.35000  112.70000
   41    43    48    58.35000  112.70000
   41    54    52    70.00000  112.02700
   41    54    55    69.00000  109.80000
   41    54    56    58.35000  112.70000
   43    41    42    37.50000  110.70000
   43    45    46    69.00000  109.80000
   43    45    47    37.50000  110.70000
   43    48    49    69.00000  109.80000
   43    48    50    70.00000  112.02700
   43    48    56    58.35000  112.70000
   45    33    34    69.00000  109.80000
   45    33    38    58.35000  112.70000
   45    43    44    37.50000  110.70000
   47    45    46    51.00000  107.60000
   48    43    44    37.50000  110.70000
   48    43    45    58.35000  112.70000
   48    50    51    75.00000  111.02000
   48    50    52    70.00000  124.00000
   48    56    54    58.35000  112.70000
   48    56    57    69.00000  109.80000
   48    56    58    69.00000  109.80000
   50    48    49    75.00000  111.90500
   50    52    53    75.00000  121.50000
   50    52    54    70.00000  124.00000
   52    50    51    75.00000  121.50000
   52    54    55    75.00000  111.90500
   52    54    56    70.00000  112.02700
   54    41    42    37.50000  110.70000
   54    41    43    58.35000  112.70000
   54    52    53    75.00000  111.02000
   54    56    57    69.00000  109.80000
   54    56    58    69.00000  109.80000
   56    48    49    69.00000  109.80000
   56    48    50    70.00000  112.02700
   56    54    55    69.00000  109.80000
   58    56    57    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   0.01700  1.0 1.0
   24    29    33    34  -0.23550 -1.0 2.0
   24    29    33    34   0.21350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    45   0.01700  1.0 1.0
   24    29    33    45  -0.23550 -1.0 2.0
   24    29    33    45   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   0.56750  1.0 1.0
   29    33    38    39  -0.07550 -1.0 2.0
   29    33    38    39   0.20000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.44750  1.0 1.0
   29    33    38    41  -0.17800 -1.0 2.0
   29    33    38    41   0.20200  1.0 3.0
   29    33    45    43   0.44750  1.0 1.0
   29    33    45    43  -0.17800 -1.0 2.0
   29    33    45    43   0.20200  1.0 3.0
   29    33    45    46   0.56750  1.0 1.0
   29    33    45    46  -0.07550 -1.0 2.0
   29    33    45    46   0.20000  1.0 3.0
   29    33    45    47   0.15000  1.0 3.0
   33    38    41    42   0.15000  1.0 3.0
   33    38   -41    43   0.56750  1.0 1.0
   33    38   -41    43  -0.07550 -1.0 2.0
   33    38   -41    43   0.20000  1.0 3.0
   33    38    41    54   0.56750  1.0 1.0
   33    38    41    54  -0.07550 -1.0 2.0
   33    38    41    54   0.20000  1.0 3.0
   34    33    38    39   0.56750  1.0 1.0
   34    33    38    39  -0.07550 -1.0 2.0
   34    33    38    39   0.20000  1.0 3.0
   34    33    38    40   0.27000  1.0 3.0
   34    33    38    41   0.35600  1.0 1.0
   34    33    38    41  -0.14650 -1.0 2.0
   34    33    38    41   0.33350  1.0 3.0
   34    33    45    43   0.35600  1.0 1.0
   34    33    45    43  -0.14650 -1.0 2.0
   34    33    45    43   0.33350  1.0 3.0
   34    33    45    46   0.22500  1.0 1.0
   34    33    45    47   0.27000  1.0 3.0
   38    33   -45    43   0.56750  1.0 1.0
   38    33   -45    43  -0.07550 -1.0 2.0
   38    33   -45    43   0.20000  1.0 3.0
   38    33    45    46   0.35600  1.0 1.0
   38    33    45    46  -0.14650 -1.0 2.0
   38    33    45    46   0.33350  1.0 3.0
   38    33    45    47   0.15000  1.0 3.0
   38    41    43    44   0.15000  1.0 3.0
   38    41   -43    45   0.56750  1.0 1.0
   38    41   -43    45  -0.07550 -1.0 2.0
   38    41   -43    45   0.20000  1.0 3.0
   38    41    43    48   0.56750  1.0 1.0
   38    41    43    48  -0.07550 -1.0 2.0
   38    41    43    48   0.20000  1.0 3.0
   38    41    54    52   0.34400  1.0 1.0
   38    41    54    52   0.09450 -1.0 2.0
   38    41    54    52   0.11100  1.0 3.0
   38    41    54    55   0.35600  1.0 1.0
   38    41    54    55  -0.14650 -1.0 2.0
   38    41    54    55   0.33350  1.0 3.0
   38    41    54    56   0.56750  1.0 1.0
   38    41    54    56  -0.07550 -1.0 2.0
   38    41    54    56   0.20000  1.0 3.0
   39    38    41    42   0.23400  1.0 3.0
   39    38    41    43   0.62750  1.0 1.0
   39    38    41    43  -0.30950 -1.0 2.0
   39    38    41    43   0.27300  1.0 3.0
   39    38    41    54   0.62750  1.0 1.0
   39    38    41    54  -0.30950 -1.0 2.0
   39    38    41    54   0.27300  1.0 3.0
   40    38    41    42   0.15000  1.0 3.0
   40    38    41    43   0.15000  1.0 3.0
   40    38    41    54   0.15000  1.0 3.0
   41    43   -45    33   0.56750  1.0 1.0
   41    43   -45    33  -0.07550 -1.0 2.0
   41    43   -45    33   0.20000  1.0 3.0
   41    43    45    46   0.35600  1.0 1.0
   41    43    45    46  -0.14650 -1.0 2.0
   41    43    45    46   0.33350  1.0 3.0
   41    43    45    47   0.15000  1.0 3.0
   41    43    48    49   0.35600  1.0 1.0
   41    43    48    49  -0.14650 -1.0 2.0
   41    43    48    49   0.33350  1.0 3.0
   41    43    48    50   0.34400  1.0 1.0
   41    43    48    50   0.09450 -1.0 2.0
   41    43    48    50   0.11100  1.0 3.0
   41    43   -48    56   0.56750  1.0 1.0
   41    43   -48    56  -0.07550 -1.0 2.0
   41    43   -48    56   0.20000  1.0 3.0
   41    54   -56    48   0.56750  1.0 1.0
   41    54   -56    48  -0.07550 -1.0 2.0
   41    54   -56    48   0.20000  1.0 3.0
   41    54    56    57   0.35600  1.0 1.0
   41    54    56    57  -0.14650 -1.0 2.0
   41    54    56    57   0.33350  1.0 3.0
   41    54    56    58   0.35600  1.0 1.0
   41    54    56    58  -0.14650 -1.0 2.0
   41    54    56    58   0.33350  1.0 3.0
   42    41    43    44   0.15000  1.0 3.0
   42    41    43    45   0.15000  1.0 3.0
   42    41    43    48   0.15000  1.0 3.0
   42    41    54    52   0.15000  1.0 3.0
   42    41    54    55   0.27000  1.0 3.0
   42    41    54    56   0.15000  1.0 3.0
   43    41    54    52   0.34400  1.0 1.0
   43    41    54    52   0.09450 -1.0 2.0
   43    41    54    52   0.11100  1.0 3.0
   43    41    54    55   0.35600  1.0 1.0
   43    41    54    55  -0.14650 -1.0 2.0
   43    41    54    55   0.33350  1.0 3.0
   43    41   -54    56   0.56750  1.0 1.0
   43    41   -54    56  -0.07550 -1.0 2.0
   43    41   -54    56   0.20000  1.0 3.0
   43    48    50    51   0.09700  1.0 1.0
   43    48    50    51   0.15600 -1.0 2.0
   43    48    50    51  -0.50800  1.0 3.0
   43    48   -50    52   0.09850  1.0 1.0
   43    48   -50    52   0.15250 -1.0 2.0
   43    48   -50    52  -0.50650  1.0 3.0
   43    48   -56    54   0.56750  1.0 1.0
   43    48   -56    54  -0.07550 -1.0 2.0
   43    48   -56    54   0.20000  1.0 3.0
   43    48    56    57   0.35600  1.0 1.0
   43    48    56    57  -0.14650 -1.0 2.0
   43    48    56    57   0.33350  1.0 3.0
   43    48    56    58   0.35600  1.0 1.0
   43    48    56    58  -0.14650 -1.0 2.0
   43    48    56    58   0.33350  1.0 3.0
   44    43    45    33   0.15000  1.0 3.0
   44    43    45    46   0.27000  1.0 3.0
   44    43    45    47   0.15000  1.0 3.0
   44    43    48    49   0.27000  1.0 3.0
   44    43    48    50   0.15000  1.0 3.0
   44    43    48    56   0.15000  1.0 3.0
   45    33    38    39   0.62750  1.0 1.0
   45    33    38    39  -0.30950 -1.0 2.0
   45    33    38    39   0.27300  1.0 3.0
   45    33    38    40   0.15000  1.0 3.0
   45    33   -38    41   0.56750  1.0 1.0
   45    33   -38    41  -0.07550 -1.0 2.0
   45    33   -38    41   0.20000  1.0 3.0
   45    43    48    49   0.35600  1.0 1.0
   45    43    48    49  -0.14650 -1.0 2.0
   45    43    48    49   0.33350  1.0 3.0
   45    43    48    50   0.34400  1.0 1.0
   45    43    48    50   0.09450 -1.0 2.0
   45    43    48    50   0.11100  1.0 3.0
   45    43    48    56   0.56750  1.0 1.0
   45    43    48    56  -0.07550 -1.0 2.0
   45    43    48    56   0.20000  1.0 3.0
   48    43    45    33   0.56750  1.0 1.0
   48    43    45    33  -0.07550 -1.0 2.0
   48    43    45    33   0.20000  1.0 3.0
   48    43    45    46   0.35600  1.0 1.0
   48    43    45    46  -0.14650 -1.0 2.0
   48    43    45    46   0.33350  1.0 3.0
   48    43    45    47   0.15000  1.0 3.0
   48    50    52    53   7.00000 -1.0 2.0
   48    50   -52    54   7.00000 -1.0 2.0
   49    48    50    51   0.09700  1.0 1.0
   49    48    50    51   0.15600 -1.0 2.0
   49    48    50    51  -0.50800  1.0 3.0
   49    48    50    52   0.09700  1.0 1.0
   49    48    50    52   0.15600 -1.0 2.0
   49    48    50    52  -0.50800  1.0 3.0
   49    48    56    54   0.35600  1.0 1.0
   49    48    56    54  -0.14650 -1.0 2.0
   49    48    56    54   0.33350  1.0 3.0
   49    48    56    57   0.22500  1.0 1.0
   49    48    56    58   0.22500  1.0 1.0
   50    48   -56    54   0.34400  1.0 1.0
   50    48   -56    54   0.09450 -1.0 2.0
   50    48   -56    54   0.11100  1.0 3.0
   50    48    56    57   0.56750  1.0 1.0
   50    48    56    57  -0.07550 -1.0 2.0
   50    48    56    57   0.20000  1.0 3.0
   50    48    56    58   0.56750  1.0 1.0
   50    48    56    58  -0.07550 -1.0 2.0
   50    48    56    58   0.20000  1.0 3.0
   50    52   -54    41   0.09850  1.0 1.0
   50    52   -54    41   0.15250 -1.0 2.0
   50    52   -54    41  -0.50650  1.0 3.0
   50    52    54    55   0.09700  1.0 1.0
   50    52    54    55   0.15600 -1.0 2.0
   50    52    54    55  -0.50800  1.0 3.0
   50    52   -54    56   0.09850  1.0 1.0
   50    52   -54    56   0.15250 -1.0 2.0
   50    52   -54    56  -0.50650  1.0 3.0
   51    50    52    53   7.00000 -1.0 2.0
   51    50    52    54   7.00000 -1.0 2.0
   52    54   -56    48   0.34400  1.0 1.0
   52    54   -56    48   0.09450 -1.0 2.0
   52    54   -56    48   0.11100  1.0 3.0
   52    54    56    57   0.56750  1.0 1.0
   52    54    56    57  -0.07550 -1.0 2.0
   52    54    56    57   0.20000  1.0 3.0
   52    54    56    58   0.56750  1.0 1.0
   52    54    56    58  -0.07550 -1.0 2.0
   52    54    56    58   0.20000  1.0 3.0
   53    52    54    41   0.09700  1.0 1.0
   53    52    54    41   0.15600 -1.0 2.0
   53    52    54    41  -0.50800  1.0 3.0
   53    52    54    55   0.09700  1.0 1.0
   53    52    54    55   0.15600 -1.0 2.0
   53    52    54    55  -0.50800  1.0 3.0
   53    52    54    56   0.09700  1.0 1.0
   53    52    54    56   0.15600 -1.0 2.0
   53    52    54    56  -0.50800  1.0 3.0
   54    41    43    44   0.15000  1.0 3.0
   54    41    43    45   0.56750  1.0 1.0
   54    41    43    45  -0.07550 -1.0 2.0
   54    41    43    45   0.20000  1.0 3.0
   54    41   -43    48   0.56750  1.0 1.0
   54    41   -43    48  -0.07550 -1.0 2.0
   54    41   -43    48   0.20000  1.0 3.0
   55    54    56    48   0.35600  1.0 1.0
   55    54    56    48  -0.14650 -1.0 2.0
   55    54    56    48   0.33350  1.0 3.0
   55    54    56    57   0.22500  1.0 1.0
   55    54    56    58   0.22500  1.0 1.0
   56    48    50    51   0.09700  1.0 1.0
   56    48    50    51   0.15600 -1.0 2.0
   56    48    50    51  -0.50800  1.0 3.0
   56    48   -50    52   0.09850  1.0 1.0
   56    48   -50    52   0.15250 -1.0 2.0
   56    48   -50    52  -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
   48    51    50    52   1.10000 -1.0 2.0
   54    53    52    50   1.10000 -1.0 2.0
END
