* LIGAND DATABASE FILE (OPLS2005)
*
001      62    63    105    169     311
    1     0 S   NP   _N1_     1    28.24517    95.85016   -21.12501
    2     1 S   H    _HN1     2     1.02854    80.42533   -20.45525
    3     1 S   H    _H1_     3     1.02962    38.38588   113.88795
    4     1 S   H    _H2_     4     1.02785    91.45697  -128.72470
    5     1 S   CT   _CA1     5     1.50544   147.14460    94.17242
    6     5 S   HC   _HA1     6     1.09694   104.59900    76.28952
    7     5 S   CO3  _C1_     7     1.54476   110.78771   -39.42759
    8     7 S   O2Z  _O11     8     1.26016   116.74281  -118.35421
    9     7 S   O2Z  _O12     9     1.26581   113.71151    60.38084
   10     5 S   CT   _CB1    10     1.53151   106.95783  -167.77015
   11    10 S   HC   HB11    11     1.09828   109.97409   -43.10957
   12    10 S   HC   HB12    12     1.09774   110.19535    73.61296
   13    10 S   CT   _CG1    13     1.52952   112.26851  -163.72707
   14    13 S   HC   HG11    14     1.09380   110.56794   -58.19716
   15    13 S   HC   HG12    15     1.09651   109.95506    60.82180
   16    13 S   C    _CD1    16     1.51746   112.53425  -178.53914
   17    16 S   O    _OE1    17     1.22725   123.40357    -2.98485
   18    16 S   N    _N2_    18     1.38525   111.53688   176.72930
   19    18 S   H    _HN2    19     1.01558   118.95618     6.01138
   20    18 S   CT1  _CA2    20     1.45841   123.10902  -179.29557
   21    20 S   HC   _HA2    21     1.09712   108.98159    21.49891
   22    20 S   C    _C2_    22     1.52792   107.15882   -95.94911
   23    22 S   O    _O2_    23     1.22957   122.88165   -26.74203
   24    20 S   CT   _CB2    32     1.53198   111.86341   144.41445
   25    24 S   HC   HB21    33     1.09579   109.83051    58.78505
   26    24 S   HC   HB22    34     1.09559   110.73656   176.84514
   27    22 S   N    _N3_    24     1.38598   112.39882   156.33496
   28    27 S   H    _HN3    25     1.01491   119.77182     0.49889
   29    24 S   S    _SG2    35     1.82468   110.90271   -63.02712
   30    27 S   CT   _CA3    26     1.45426   122.66580   174.77929
   31    30 S   HC   HA31    27     1.09548   108.79177    33.37010
   32    30 S   HC   HA32    28     1.09475   107.19340   150.51319
   33    29 S   CM   _C11    36     1.74536    99.82612   159.39122
   34    33 S   Cl   Cl1_    37     1.74789   113.53354    95.38806
   35    30 S   CO3  _C3_    29     1.53099   113.81461   -89.40313
   36    35 S   O2Z  _O31    30     1.26358   115.97663   -26.20843
   37    35 S   O2Z  _O32    31     1.26434   114.55549   154.59048
   38    33 S   CM   _C10    38     1.35795   124.39658   -85.56172
   39    38 S   CA   _C9_    39     1.48923   121.04966    -0.62181
   40    38 S   CA   _C12    50     1.48968   119.74266   179.92338
   41    39 S   CA   _C4_    40     1.40279   120.71744   -76.09296
   42    41 S   HA   _H3_    41     1.08768   120.62946     0.50241
   43    40 S   CA   _C13    51     1.40506   117.94752   100.04658
   44    43 S   HA   _H7_    52     1.08828   120.51606    -0.76694
   45    41 S   CA   _C5_    42     1.39632   120.38021  -179.70859
   46    45 S   HA   _H4_    43     1.08711   119.42549  -179.35745
   47    43 S   CA   _C14    53     1.39648   120.79600   179.33854
   48    47 S   HA   _H8_    54     1.08699   119.25663   179.89532
   49    45 S   CA   _C6_    44     1.39405   119.74402     0.32143
   50    49 S   Cl   Cl3_    45     1.72164   119.84161  -179.56795
   51    47 S   CA   _C15    55     1.39352   119.86225    -0.17359
   52    51 S   Cl   Cl2_    56     1.72483   119.06281  -179.93744
   53    49 S   CA   _C7_    46     1.39372   120.48359     0.15826
   54    53 S   HA   _H5_    47     1.08679   120.87407   179.89721
   55    51 S   CA   _C16    57     1.39597   120.01718     0.04846
   56    39 S   CA   _C8_    48     1.40221   120.04903   105.03448
   57    56 S   HA   _H6_    49     1.08722   120.80506    -0.63674
   58    40 S   CA   _C17    58     1.40534   123.23359   -80.82586
   59    55 S   OH   _O34    61     1.36996   121.11064  -179.94405
   60    59 S   HO   _H10    62     0.97315   107.99843    -0.09691
   61    58 S   OH   _O33    59     1.37052   122.34408     0.77329
   62    61 S   HO   _H9_    60     0.97020   109.97007     4.49950
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   7   3   2   7   4   5   5   4   3
   8   3   2   1   1  14  12  12   8   4   8   4   6   3   6   3
   5   3   6   3   3   2   5   1   1   4   2   1   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    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    41    56    40    43    58  
   38    39    40  
   36    37  
   37  
    0  
   39    41    42    45    53    56    57    40    43    44    47    55    58    61  
   41    42    45    46    49    53    54    56    57    40    43    58  
   43    44    47    48    51    55    58    61    62    59    41    56  
   42    45    46    49    50    53    56    57  
   45    46    49    56  
   44    47    48    51    52    55    58    61  
   47    48    51    58  
   46    49    50    53    54    56  
   49    50    53  
   48    51    52    55    58    59  
   51    52    55  
   50    53    54    56    57  
   53    54    56  
   52    55    58    61    59    60  
   55    58    59  
   54    56    57  
   56    57  
   58    61    62    59    60  
   57  
    0  
   61    62    59    60  
   60    61  
    0  
   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  -0.175000   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   3.5500   0.0760   0.127500   2.0020   1.7750   0.023028004  -0.852763146
   34   3.4000   0.3000  -0.120000   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   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   40   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   41   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   43   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   44   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   48   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   49   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   50   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   51   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   52   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   53   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   54   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   55   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   56   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   57   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   58   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   59   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   60   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   61   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   62   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
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   240.000  1.763
   33    34   300.000  1.725
   33    38   549.000  1.340
   38    39   320.000  1.460
   38    40   320.000  1.460
   39    41   469.000  1.400
   39    56   469.000  1.400
   41    42   367.000  1.080
   41    45   469.000  1.400
   45    46   367.000  1.080
   45    49   469.000  1.400
   49    50   300.000  1.725
   49    53   469.000  1.400
   53    54   367.000  1.080
   53    56   469.000  1.400
   56    57   367.000  1.080
   40    43   469.000  1.400
   40    58   469.000  1.400
   43    44   367.000  1.080
   43    47   469.000  1.400
   47    48   367.000  1.080
   47    51   469.000  1.400
   51    52   300.000  1.725
   51    55   469.000  1.400
   55    58   469.000  1.400
   55    59   450.000  1.364
   58    61   450.000  1.364
   61    62   553.000  0.945
   59    60   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    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    85.00000  102.41200
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    75.00000  112.00000
   29    33    38    65.00000  122.11800
   33    38    39    60.00000  123.20500
   33    38    40    60.00000  123.20500
   38    33    34    75.00000  121.50000
   38    39    41    60.00000  120.93500
   38    39    56    60.00000  120.93500
   38    40    43    60.00000  120.93500
   38    40    58    60.00000  120.93500
   39    41    42    35.00000  120.00000
   39    41    45    63.00000  120.00000
   39    56    53    63.00000  120.00000
   39    56    57    35.00000  120.00000
   41    45    46    35.00000  120.00000
   41    45    49    63.00000  120.00000
   45    41    42    35.00000  120.00000
   45    49    50    75.00000  120.00000
   45    49    53    63.00000  120.00000
   49    45    46    35.00000  120.00000
   49    53    54    35.00000  120.00000
   49    53    56    63.00000  120.00000
   53    49    50    75.00000  120.00000
   53    56    57    35.00000  120.00000
   56    39    41    63.00000  120.00000
   56    53    54    35.00000  120.00000
   40    38    39    60.00000  122.92000
   40    43    44    35.00000  120.00000
   40    43    47    63.00000  120.00000
   40    58    55    63.00000  120.00000
   40    58    61    70.00000  120.00000
   43    47    48    35.00000  120.00000
   43    47    51    63.00000  120.00000
   47    43    44    35.00000  120.00000
   47    51    52    75.00000  120.00000
   47    51    55    63.00000  120.00000
   51    47    48    35.00000  120.00000
   51    55    58    63.00000  120.00000
   51    55    59    70.00000  120.00000
   55    51    52    75.00000  120.00000
   55    58    61    70.00000  120.00000
   55    59    60    35.00000  113.00000
   58    40    43    63.00000  120.00000
   58    61    62    35.00000  113.00000
   59    55    58    70.00000  120.00000
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   0.00000  1.0 1.0
   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   1.00000 -1.0 2.0
   24    29    33    38   1.00000 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    38    39   7.00000 -1.0 2.0
   29    33    38    40   7.00000 -1.0 2.0
   33    38    39    41   0.15800  1.0 1.0
   33    38    39    41   1.85350 -1.0 2.0
   33    38    39    41  -0.48700  1.0 3.0
   33    38    39    56   0.15800  1.0 1.0
   33    38    39    56   1.85350 -1.0 2.0
   33    38    39    56  -0.48700  1.0 3.0
   33    38    40    43   0.15800  1.0 1.0
   33    38    40    43   1.85350 -1.0 2.0
   33    38    40    43  -0.48700  1.0 3.0
   33    38    40    58   0.15800  1.0 1.0
   33    38    40    58   1.85350 -1.0 2.0
   33    38    40    58  -0.48700  1.0 3.0
   34    33    38    39   7.00000 -1.0 2.0
   34    33    38    40   7.00000 -1.0 2.0
   38    39    41    42   3.62500 -1.0 2.0
   38    39    41    45   3.62500 -1.0 2.0
   38    39    56    53   3.62500 -1.0 2.0
   38    39    56    57   3.62500 -1.0 2.0
   38    40    43    44   3.62500 -1.0 2.0
   38    40    43    47   3.62500 -1.0 2.0
   38    40    58    55   3.62500 -1.0 2.0
   38    40    58    61   3.62500 -1.0 2.0
   39    38    40    43  -0.01750  1.0 1.0
   39    38    40    43  -0.32000 -1.0 2.0
   39    38    40    43   0.00600  1.0 3.0
   39    38    40    58  -0.01750  1.0 1.0
   39    38    40    58  -0.32000 -1.0 2.0
   39    38    40    58   0.00600  1.0 3.0
   39    41    45    46   3.62500 -1.0 2.0
   39    41    45    49   3.62500 -1.0 2.0
   41    39    56    53   3.62500 -1.0 2.0
   41    39    56    57   3.62500 -1.0 2.0
   41    45    49    50   3.62500 -1.0 2.0
   41    45   -49    53   3.62500 -1.0 2.0
   42    41    45    46   3.62500 -1.0 2.0
   42    41    45    49   3.62500 -1.0 2.0
   45    49    53    54   3.62500 -1.0 2.0
   45    49    53    56   3.62500 -1.0 2.0
   46    45    49    50   3.62500 -1.0 2.0
   46    45    49    53   3.62500 -1.0 2.0
   49    53   -56    39   3.62500 -1.0 2.0
   49    53    56    57   3.62500 -1.0 2.0
   50    49    53    54   3.62500 -1.0 2.0
   50    49    53    56   3.62500 -1.0 2.0
   54    53    56    39   3.62500 -1.0 2.0
   54    53    56    57   3.62500 -1.0 2.0
   56    39    41    42   3.62500 -1.0 2.0
   56    39   -41    45   3.62500 -1.0 2.0
   40    38    39    41  -0.01750  1.0 1.0
   40    38    39    41  -0.32000 -1.0 2.0
   40    38    39    41   0.00600  1.0 3.0
   40    38    39    56  -0.01750  1.0 1.0
   40    38    39    56  -0.32000 -1.0 2.0
   40    38    39    56   0.00600  1.0 3.0
   40    43    47    48   3.62500 -1.0 2.0
   40    43    47    51   3.62500 -1.0 2.0
   40    58    61    62   0.84100 -1.0 2.0
   43    40    58    55   3.62500 -1.0 2.0
   43    40    58    61   3.62500 -1.0 2.0
   43    47    51    52   3.62500 -1.0 2.0
   43    47   -51    55   3.62500 -1.0 2.0
   44    43    47    48   3.62500 -1.0 2.0
   44    43    47    51   3.62500 -1.0 2.0
   47    51    55    58   3.62500 -1.0 2.0
   47    51    55    59   3.62500 -1.0 2.0
   48    47    51    52   3.62500 -1.0 2.0
   48    47    51    55   3.62500 -1.0 2.0
   51    55   -58    40   3.62500 -1.0 2.0
   51    55    58    61   3.62500 -1.0 2.0
   51    55    59    60   0.84100 -1.0 2.0
   52    51    55    58   3.62500 -1.0 2.0
   52    51    55    59   3.62500 -1.0 2.0
   55    58    61    62   0.84100 -1.0 2.0
   58    40    43    44   3.62500 -1.0 2.0
   58    40   -43    47   3.62500 -1.0 2.0
   58    55    59    60   0.84100 -1.0 2.0
   59    55    58    40   3.62500 -1.0 2.0
   59    55    58    61   3.62500 -1.0 2.0
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
   29    34    33    38  15.00000 -1.0 2.0
   39    40    38    33  15.00000 -1.0 2.0
   41    56    39    38   4.00000 -1.0 2.0
   45    42    41    39   1.10000 -1.0 2.0
   49    46    45    41   1.10000 -1.0 2.0
   53    50    49    45   4.00000 -1.0 2.0
   56    54    53    49   1.10000 -1.0 2.0
   53    57    56    39   1.10000 -1.0 2.0
   43    58    40    38   4.00000 -1.0 2.0
   47    44    43    40   1.10000 -1.0 2.0
   51    48    47    43   1.10000 -1.0 2.0
   55    52    51    47   4.00000 -1.0 2.0
   58    59    55    51   4.00000 -1.0 2.0
   55    61    58    40   4.00000 -1.0 2.0
END
