* LIGAND DATABASE FILE (OPLS2005)
*
001      62    62    115    176     342
    1     0 S   NP   _N1_     1    28.95331    96.81126   -20.95836
    2     1 S   H    _HN1     2     1.02951    74.79351    22.86384
    3     1 S   H    _H1_     3     1.02829    47.14829   154.71762
    4     1 S   H    _H2_     4     1.02783    86.78799   -87.13861
    5     1 S   CT   _CA1     5     1.50102   156.09610   129.03151
    6     5 S   HC   _HA1     6     1.09571   105.22802    79.08026
    7     5 S   CO3  _C1_     7     1.53812   112.43495   -41.20408
    8     7 S   O2Z  _O11     8     1.26372   115.01304   -43.16201
    9     7 S   O2Z  _O12     9     1.26241   114.95234   136.05872
   10     5 S   CT   _CB1    10     1.53092   107.43306  -162.91272
   11    10 S   HC   HB11    11     1.09827   109.44568   -49.79729
   12    10 S   HC   HB12    12     1.09815   110.41263    66.82917
   13    10 S   CT   _CG1    13     1.52970   112.56497  -170.79431
   14    13 S   HC   HG11    14     1.09591   110.55605   -63.75433
   15    13 S   HC   HG12    15     1.09664   109.86729    55.46032
   16    13 S   C    _CD1    16     1.51788   112.33896   175.94295
   17    16 S   O    _OE1    17     1.22716   123.33839     2.81132
   18    16 S   N    _N2_    18     1.38633   111.56328  -177.33010
   19    18 S   H    _HN2    19     1.01584   118.93090     2.12688
   20    18 S   CT1  _CA2    20     1.46208   123.45439   178.97340
   21    20 S   HC   _HA2    21     1.09735   109.43406    -1.21644
   22    20 S   C    _C2_    22     1.53482   108.50576  -116.75334
   23    22 S   O    _O2_    23     1.23046   122.31421  -147.68434
   24    20 S   CT   _CB2    32     1.53470   111.38121   120.85324
   25    24 S   HC   HB21    33     1.09357   109.44122    56.15192
   26    24 S   HC   HB22    34     1.09449   109.85599   174.97383
   27    22 S   N    _N3_    24     1.38343   113.61494    39.76432
   28    27 S   H    _HN3    25     1.01610   119.55390    -3.45377
   29    24 S   S    _SG2    35     1.83026   111.05239   -65.61757
   30    27 S   CT   _CA3    26     1.45287   123.16034   177.04865
   31    30 S   HC   HA31    27     1.09551   107.51619   -64.21036
   32    30 S   HC   HA32    28     1.09558   107.96523    52.20878
   33    29 S   CT   _C10    36     1.87964   102.38253   168.32346
   34    30 S   CO3  _C3_    29     1.52946   114.11802   174.20123
   35    34 S   O2Z  _O31    30     1.26369   116.06866    -0.72793
   36    34 S   O2Z  _O32    31     1.26430   114.41002   179.33119
   37    33 S   CT   _C7_    37     1.55701   107.10370   -69.99380
   38    37 S   HC   _H19    38     1.10068   107.97987   -43.86725
   39    37 S   HC   _H20    39     1.09747   110.35282    71.13449
   40    33 S   CT   _C12    59     1.53986   108.15924    51.54281
   41    40 S   HC   _H23    60     1.09652   112.12326    44.64413
   42    40 S   HC   _H24    61     1.09553   111.78096   -76.09278
   43    40 S   HC   _H25    62     1.09317   112.11299   163.82758
   44    37 S   CT   _C11    40     1.55175   116.97615  -163.93435
   45    44 S   Cl   CL14    41     1.80554   109.48876   -73.96625
   46    44 S   CT   _C9_    42     1.54654   109.75775    48.67028
   47    46 S   Cl   CL13    43     1.79568   113.19628  -176.73008
   48    46 S   HC   _H22    44     1.09727   108.47324    67.58794
   49    44 S   CT   _C13    55     1.54001   108.50759   170.21194
   50    49 S   HC   _H26    56     1.09527   112.26240   175.31220
   51    49 S   HC   _H27    57     1.09651   111.20249    55.07467
   52    49 S   HC   _H28    58     1.09600   110.98637   -64.35007
   53    46 S   CT   _C6_    45     1.52998   113.09526   -51.94560
   54    53 S   HC   _H17    46     1.09704   110.78630   -65.86841
   55    53 S   HC   _H18    47     1.09916   109.00374   177.91362
   56    33 S   CT   _C8_    48     1.56663   106.63099   172.60880
   57    56 S   HC   _H21    49     1.10157   107.68238    51.10827
   58    56 S   CM   _C4_    50     1.51671   114.42934   -69.03469
   59    58 S   HC   _H15    51     1.08784   117.29055   -65.54669
   60    58 S   CM   _C5_    52     1.33649   123.45576   115.28640
   61    60 S   Cl   CL12    53     1.71262   122.92944   179.71196
   62    60 S   HC   _H16    54     1.08187   124.51214    -0.52152
  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  13   5   4   3
  19   2   1   1  19   7   6   8   3   2   1  12   8  12   6   5
   4   2   1   1   7   4   3   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    56    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    44    53    56    57    58    40    41    42    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    44    45    46    53    54    55    56    57    58    59    60    49    40    41    42    43  
   35    36  
   36  
    0  
   38    39    44    45    46    47    48    53    56    57    58    49    50    51    52    40    41    42    43  
   39    44    45    46    56    49    40  
   44    45    46    56    49    40  
   41    42    43    44    53    56    57    58  
   42    43    56  
   43    56  
   56  
   45    46    47    48    53    54    55    56    49    50    51    52  
   46    47    48    53    49    50    51    52  
   47    48    53    54    55    56    57    58    49    50    51    52  
   48    53    54    55    56    49  
   53    54    55    56    49  
   50    51    52    53  
   51    52  
   52  
    0  
   54    55    56    57    58    59    60  
   55    56    57    58  
   56    57    58  
   57    58    59    60    61    62  
   58    59    60  
   59    60    61    62  
   60    61    62  
   61    62  
   62  
    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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   45   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   46   3.5000   0.0660   0.097000   1.9750   1.7500   0.005000000  -0.741685710
   47   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   48   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   59   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5500   0.0760   0.005000   2.0020   1.7750   0.023028004  -0.852763146
   61   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   62   2.4200   0.0300   0.115000   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   268.000  1.529
   33    56   268.000  1.529
   33    40   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    44   268.000  1.529
   44    45   245.000  1.781
   44    46   268.000  1.529
   44    49   268.000  1.529
   46    47   245.000  1.781
   46    48   340.000  1.090
   46    53   268.000  1.529
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   268.000  1.529
   56    57   340.000  1.090
   56    58   317.000  1.510
   58    59   340.000  1.080
   58    60   549.000  1.340
   60    61   300.000  1.725
   60    62   340.000  1.080
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   340.000  1.090
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    43   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  111.63000
   29    33    56    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    44    58.35000  112.70000
   33    56    53    58.35000  112.70000
   33    56    57    37.50000  110.70000
   33    56    58    70.00000  112.02700
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    43    37.50000  110.70000
   37    44    45    69.00000  109.80000
   37    44    46    58.35000  112.70000
   37    44    49    58.35000  112.70000
   39    37    38    33.00000  107.80000
   44    37    38    37.50000  110.70000
   44    37    39    37.50000  110.70000
   44    46    47    69.00000  109.80000
   44    46    48    37.50000  110.70000
   44    46    53    58.35000  112.70000
   44    49    50    37.50000  110.70000
   44    49    51    37.50000  110.70000
   44    49    52    37.50000  110.70000
   46    44    45    69.00000  109.80000
   46    53    54    37.50000  110.70000
   46    53    55    37.50000  110.70000
   46    53    56    58.35000  112.70000
   48    46    47    51.00000  107.60000
   53    46    47    69.00000  109.80000
   53    46    48    37.50000  110.70000
   53    56    57    37.50000  110.70000
   53    56    58    70.00000  112.02700
   55    53    54    33.00000  107.80000
   56    33    37    58.35000  112.70000
   56    53    54    37.50000  110.70000
   56    53    55    37.50000  110.70000
   56    58    59    35.00000  117.00000
   56    58    60    70.00000  124.00000
   58    56    57    35.00000  109.50000
   58    60    61    75.00000  121.50000
   58    60    62    35.00000  120.00000
   60    58    59    35.00000  120.00000
   62    60    61    60.00000  114.00000
   49    44    45    69.00000  109.80000
   49    44    46    58.35000  112.70000
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    33.00000  107.80000
   40    33    37    58.35000  112.70000
   40    33    56    58.35000  112.70000
   42    40    41    33.00000  107.80000
   43    40    41    33.00000  107.80000
   43    40    42    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   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    56   0.01700  1.0 1.0
   24    29    33    56  -0.23550 -1.0 2.0
   24    29    33    56   0.21350  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   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   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    44   0.44750  1.0 1.0
   29    33    37    44  -0.17800 -1.0 2.0
   29    33    37    44   0.20200  1.0 3.0
   29    33    56    53   0.44750  1.0 1.0
   29    33    56    53  -0.17800 -1.0 2.0
   29    33    56    53   0.20200  1.0 3.0
   29    33    56    57   0.15000  1.0 3.0
   29    33    56    58   0.56750  1.0 1.0
   29    33    56    58  -0.07550 -1.0 2.0
   29    33    56    58   0.20000  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    42   0.15000  1.0 3.0
   29    33    40    43   0.15000  1.0 3.0
   33    37    44    45   0.35600  1.0 1.0
   33    37    44    45  -0.14650 -1.0 2.0
   33    37    44    45   0.33350  1.0 3.0
   33    37    44    46   0.56750  1.0 1.0
   33    37    44    46  -0.07550 -1.0 2.0
   33    37    44    46   0.20000  1.0 3.0
   33    37    44    49   0.56750  1.0 1.0
   33    37    44    49  -0.07550 -1.0 2.0
   33    37    44    49   0.20000  1.0 3.0
   33    56    58    59   0.00000  1.0 1.0
   33    56    58    60   0.09850  1.0 1.0
   33    56    58    60   0.15250 -1.0 2.0
   33    56    58    60  -0.50650  1.0 3.0
   37    33    56    53   0.56750  1.0 1.0
   37    33    56    53  -0.07550 -1.0 2.0
   37    33    56    53   0.20000  1.0 3.0
   37    33    56    57   0.15000  1.0 3.0
   37    33    56    58   0.34400  1.0 1.0
   37    33    56    58   0.09450 -1.0 2.0
   37    33    56    58   0.11100  1.0 3.0
   37    33    40    41   0.15000  1.0 3.0
   37    33    40    42   0.15000  1.0 3.0
   37    33    40    43   0.15000  1.0 3.0
   37    44    46    47   0.35600  1.0 1.0
   37    44    46    47  -0.14650 -1.0 2.0
   37    44    46    47   0.33350  1.0 3.0
   37    44    46    48   0.15000  1.0 3.0
   37    44   -46    53   0.56750  1.0 1.0
   37    44   -46    53  -0.07550 -1.0 2.0
   37    44   -46    53   0.20000  1.0 3.0
   37    44    49    50   0.15000  1.0 3.0
   37    44    49    51   0.15000  1.0 3.0
   37    44    49    52   0.15000  1.0 3.0
   38    37    44    45   0.27000  1.0 3.0
   38    37    44    46   0.15000  1.0 3.0
   38    37    44    49   0.15000  1.0 3.0
   39    37    44    45   0.27000  1.0 3.0
   39    37    44    46   0.15000  1.0 3.0
   39    37    44    49   0.15000  1.0 3.0
   44    46    53    54   0.15000  1.0 3.0
   44    46    53    55   0.15000  1.0 3.0
   44    46    53    56   0.56750  1.0 1.0
   44    46    53    56  -0.07550 -1.0 2.0
   44    46    53    56   0.20000  1.0 3.0
   45    44    46    47   0.22500  1.0 1.0
   45    44    46    48   0.27000  1.0 3.0
   45    44    46    53   0.35600  1.0 1.0
   45    44    46    53  -0.14650 -1.0 2.0
   45    44    46    53   0.33350  1.0 3.0
   45    44    49    50   0.27000  1.0 3.0
   45    44    49    51   0.27000  1.0 3.0
   45    44    49    52   0.27000  1.0 3.0
   46    44    49    50   0.15000  1.0 3.0
   46    44    49    51   0.15000  1.0 3.0
   46    44    49    52   0.15000  1.0 3.0
   46    53   -56    33   0.56750  1.0 1.0
   46    53   -56    33  -0.07550 -1.0 2.0
   46    53   -56    33   0.20000  1.0 3.0
   46    53    56    57   0.15000  1.0 3.0
   46    53    56    58   0.34400  1.0 1.0
   46    53    56    58   0.09450 -1.0 2.0
   46    53    56    58   0.11100  1.0 3.0
   47    46    53    54   0.27000  1.0 3.0
   47    46    53    55   0.27000  1.0 3.0
   47    46    53    56   0.35600  1.0 1.0
   47    46    53    56  -0.14650 -1.0 2.0
   47    46    53    56   0.33350  1.0 3.0
   48    46    53    54   0.15000  1.0 3.0
   48    46    53    55   0.15000  1.0 3.0
   48    46    53    56   0.15000  1.0 3.0
   53    56    58    59   0.00000  1.0 1.0
   53    56    58    60   0.09850  1.0 1.0
   53    56    58    60   0.15250 -1.0 2.0
   53    56    58    60  -0.50650  1.0 3.0
   54    53    56    33   0.15000  1.0 3.0
   54    53    56    57   0.15000  1.0 3.0
   54    53    56    58   0.15000  1.0 3.0
   55    53    56    33   0.15000  1.0 3.0
   55    53    56    57   0.15000  1.0 3.0
   55    53    56    58   0.15000  1.0 3.0
   56    33    37    38   0.15000  1.0 3.0
   56    33    37    39   0.15000  1.0 3.0
   56    33   -37    44   0.56750  1.0 1.0
   56    33   -37    44  -0.07550 -1.0 2.0
   56    33   -37    44   0.20000  1.0 3.0
   56    33    40    41   0.15000  1.0 3.0
   56    33    40    42   0.15000  1.0 3.0
   56    33    40    43   0.15000  1.0 3.0
   56    58    60    61   7.00000 -1.0 2.0
   56    58    60    62   7.00000 -1.0 2.0
   57    56    58    59   0.33100  1.0 3.0
   57    56    58    60   0.00000  1.0 1.0
   59    58    60    61   7.00000 -1.0 2.0
   59    58    60    62   7.00000 -1.0 2.0
   49    44    46    47   0.35600  1.0 1.0
   49    44    46    47  -0.14650 -1.0 2.0
   49    44    46    47   0.33350  1.0 3.0
   49    44    46    48   0.15000  1.0 3.0
   49    44    46    53   0.56750  1.0 1.0
   49    44    46    53  -0.07550 -1.0 2.0
   49    44    46    53   0.20000  1.0 3.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    44   0.56750  1.0 1.0
   40    33    37    44  -0.07550 -1.0 2.0
   40    33    37    44   0.20000  1.0 3.0
   40    33    56    53   0.56750  1.0 1.0
   40    33    56    53  -0.07550 -1.0 2.0
   40    33    56    53   0.20000  1.0 3.0
   40    33    56    57   0.15000  1.0 3.0
   40    33    56    58   0.34400  1.0 1.0
   40    33    56    58   0.09450 -1.0 2.0
   40    33    56    58   0.11100  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
   56    59    58    60  15.00000 -1.0 2.0
   61    62    60    58  15.00000 -1.0 2.0
END
