* LIGAND DATABASE FILE (OPLS2005)
*
001      71    73    130    210     381
    1     0 S   NP   _N1_     1    28.71410    96.18014   -23.04111
    2     1 S   H    _HN1     2     1.02949    74.61693     5.58241
    3     1 S   H    _H1_     3     1.02828    36.60232   157.38970
    4     1 S   H    _H2_     4     1.02787   103.10328  -100.16611
    5     1 S   CT   _CA1     5     1.50111   139.61132   109.16075
    6     5 S   HC   _HA1     6     1.09572   105.19480    87.65310
    7     5 S   CO3  _C1_     7     1.53788   112.45534   -32.58735
    8     7 S   O2Z  _O11     8     1.26373   115.00916   -42.78836
    9     7 S   O2Z  _O12     9     1.26239   114.94743   136.32919
   10     5 S   CT   _CB1    10     1.53075   107.41821  -154.36358
   11    10 S   HC   HB11    11     1.09834   109.37919   -49.65629
   12    10 S   HC   HB12    12     1.09812   110.44849    66.95453
   13    10 S   CT   _CG1    13     1.52990   112.60175  -170.62495
   14    13 S   HC   HG11    14     1.09582   110.63954   -65.59445
   15    13 S   HC   HG12    15     1.09670   109.78133    53.63792
   16    13 S   C    _CD1    16     1.51801   112.20618   174.10013
   17    16 S   O    _OE1    17     1.22731   123.27944     7.20143
   18    16 S   N    _N2_    18     1.38647   111.67698  -172.88043
   19    18 S   H    _HN2    19     1.01579   118.93230     1.82756
   20    18 S   CT1  _CA2    20     1.46204   123.41699   177.61017
   21    20 S   HC   _HA2    21     1.09732   109.38089     4.06934
   22    20 S   C    _C2_    22     1.53568   108.67180  -111.50927
   23    22 S   O    _O2_    23     1.23069   122.25392  -147.74081
   24    20 S   CT   _CB2    32     1.53324   111.52470   126.12007
   25    24 S   HC   HB21    33     1.09496   109.80268    56.28400
   26    24 S   HC   HB22    34     1.09512   110.16855   175.34701
   27    22 S   N    _N3_    24     1.38318   113.74796    39.67031
   28    27 S   H    _HN3    25     1.01575   119.59441    -3.22956
   29    24 S   S    _SG2    35     1.82763   111.51611   -64.82081
   30    27 S   CT   _CA3    26     1.45283   123.22130   177.18986
   31    30 S   HC   HA31    27     1.09549   107.50347   -64.80424
   32    30 S   HC   HA32    28     1.09557   107.99507    51.63806
   33    29 S   CT   _C12    36     1.85638    99.77787  -176.40942
   34    33 S   HC   _H5_    37     1.09682   105.97110    44.35074
   35    30 S   CO3  _C3_    29     1.52963   114.07693   173.63742
   36    35 S   O2Z  _O31    30     1.26376   116.07219    -0.73515
   37    35 S   O2Z  _O32    31     1.26428   114.41208   179.32856
   38    33 S   CA   _C13    38     1.51952   109.31434   -74.05403
   39    33 S   CT   _C11    49     1.54736   109.61676   160.65549
   40    39 S   HC   _H4_    50     1.10108   109.69087    47.17801
   41    38 S   CA   _C14    39     1.40479   119.64101   108.33900
   42    41 S   HA   _H15    40     1.08760   120.40358    -0.11535
   43    39 S   C    _C10    51     1.53064   114.36261   -71.18900
   44    43 S   O    _O33    52     1.22007   127.13768    30.13775
   45    41 S   CA   _C15    41     1.39569   120.76531   179.75292
   46    45 S   HA   _H16    42     1.08631   119.95977  -179.87180
   47    43 S   N    _N6_    53     1.39087   107.12130  -151.31516
   48    47 S   H    _H14    54     1.01510   122.93123  -176.36460
   49    45 S   CA   _C16    43     1.39256   120.04626     0.26761
   50    49 S   HA   _H17    44     1.08621   120.05636   179.87489
   51    47 S   CT   _C9_    55     1.43696   112.85789     3.09927
   52    51 S   HC   _H12    56     1.09500   107.43739   -99.06059
   53    51 S   HC   _H13    57     1.09383   109.71295   141.91713
   54    49 S   CA   _C17    45     1.39291   119.91335     0.17246
   55    54 S   HA   _H18    46     1.08645   119.95889   179.59993
   56    39 S   CT   _C8_    58     1.55318   117.85122   169.85117
   57    56 S   HC   _H3_    59     1.09659   110.81563   -83.37924
   58    38 S   CA   _C18    47     1.40408   121.88714   -71.21957
   59    58 S   HA   _H19    48     1.08725   120.63342     0.40494
   60    56 S   C5X  _C6_    60     1.48971   115.01996    38.59971
   61    60 S   C5X  _C5_    61     1.37758   130.98875  -124.93446
   62    61 S   HA   _H9_    62     1.07454   134.09207     0.24866
   63    61 S   N5P  _N4_    63     1.38232   108.07918   179.26007
   64    63 S   CRP  _C7_    64     1.33998   108.49242     0.89766
   65    64 S   HA   _H11    65     1.07873   126.31261   179.66839
   66    63 S   CT   _C4_    68     1.45247   125.91518  -178.99712
   67    66 S   HC   _H6_    69     1.09333   109.09651    61.00209
   68    66 S   HC   _H7_    70     1.09320   109.91911  -179.09648
   69    66 S   HC   _H8_    71     1.09325   109.17513   -59.16067
   70    60 S   N5P  _N5_    66     1.38473   124.05304    55.48690
   71    70 S   H    _H10    67     1.01656   125.24649     0.79278
  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
  17   7   2   1   1  13  15   7   8   4   9   4   6   3   7   4
   5   3   7   4   3   3   2   8   3   1   1   8  10   4   8   7
   3   4   2   1   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    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    58    39    40    43    56  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    45    54    58    59    39    40    43    44    47    51    56    57    60  
   38    41    58    39    40    43    56  
   36    37  
   37  
    0  
   41    42    45    46    49    54    55    58    59    39    40    43    56  
   40    43    44    47    48    51    52    53    56    57    60    61    70    41    58  
   43    44    47    51    56    57    60  
   42    45    46    49    50    54    58    59  
   45    46    49    58  
   44    47    48    51    52    53    56    57    60  
   47    48    51    56  
   46    49    50    54    55    58  
   49    50    54  
   48    51    52    53    56    57    60  
   51    52    53    56  
   50    54    55    58    59  
   54    55    58  
   52    53    56    57    60    61    70  
   53    56    57    60  
   56    57    60  
   55    58    59  
   58    59  
   57    60    61    62    63    64    70    71  
   60    61    70  
   59  
    0  
   61    62    63    64    65    70    71    66  
   62    63    64    65    70    71    66    67    68    69  
   63    64    70    66  
   64    65    70    71    66    67    68    69  
   65    70    71    66    67    68    69  
   70    71    66  
   67    68    69    70  
   68    69  
   69  
    0  
   71  
    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   0.222500   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   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   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   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   48   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   49   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   50   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   51   3.5000   0.0660   0.080000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   54   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   55   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   56   3.5000   0.0660   0.055000   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   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   59   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   60   3.5500   0.0700  -0.031100   2.0020   1.7750   0.001000000  -0.843144165
   61   3.5500   0.0700   0.055400   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.182200   1.3810   1.2100   0.030040813   0.268726247
   63   3.2500   0.1700   0.024800   1.9750   1.7500   0.001000000  -0.511443539
   64   3.5500   0.0700   0.100100   2.0020   1.7750   0.001000000  -0.843144165
   65   2.4200   0.0300   0.237700   1.3810   1.2100   0.030040813   0.268726247
   66   3.5000   0.0660  -0.057500   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.2500   0.1700  -0.186300   1.8650   1.6500   0.001000000  -0.511443539
   71   0.0000   0.0000   0.379700   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   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    39   268.000  1.529
   38    41   469.000  1.400
   38    58   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   367.000  1.080
   49    54   469.000  1.400
   54    55   367.000  1.080
   54    58   469.000  1.400
   58    59   367.000  1.080
   39    40   340.000  1.090
   39    43   317.000  1.522
   39    56   268.000  1.529
   43    44   570.000  1.229
   43    47   490.000  1.335
   47    48   434.000  1.010
   47    51   337.000  1.449
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    56   268.000  1.529
   56    57   340.000  1.090
   56    60   295.000  1.488
   60    61   520.000  1.370
   60    70   455.000  1.369
   61    62   367.000  1.080
   61    63   455.000  1.369
   63    64   520.000  1.338
   63    66   300.000  1.456
   64    65   400.000  1.075
   64    70   520.000  1.338
   70    71   505.000  1.012
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   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    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    80.00000  109.48900
   29    33    39    75.00000  111.63000
   33    38    41    70.00000  120.00000
   33    38    58    70.00000  120.00000
   33    39    40    37.50000  110.70000
   33    39    43    63.00000  111.10000
   33    39    56    58.35000  112.70000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    45    63.00000  120.00000
   38    58    54    63.00000  120.00000
   38    58    59    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    35.00000  120.00000
   45    49    54    63.00000  120.00000
   49    45    46    35.00000  120.00000
   49    54    55    35.00000  120.00000
   49    54    58    63.00000  120.00000
   54    49    50    35.00000  120.00000
   54    58    59    35.00000  120.00000
   58    38    41    63.00000  120.00000
   58    54    55    35.00000  120.00000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.17500
   39    43    44    80.00000  120.40000
   39    43    47    70.00000  116.60000
   39    56    51    58.35000  112.70000
   39    56    57    37.50000  110.70000
   39    56    60    70.00000  111.35000
   43    39    40    35.00000  109.50000
   43    47    48    35.00000  119.80000
   43    47    51    50.00000  121.90000
   47    43    44    80.00000  122.90000
   47    51    52    35.00000  109.50000
   47    51    53    35.00000  109.50000
   47    51    56    70.00000  110.72300
   51    47    48    38.00000  118.40000
   51    56    57    37.50000  110.70000
   51    56    60    70.00000  111.35000
   53    51    52    33.00000  107.80000
   56    39    40    37.50000  110.70000
   56    39    43    63.00000  111.10000
   56    51    52    37.50000  110.70000
   56    51    53    37.50000  110.70000
   56    60    61    55.00000  134.05000
   56    60    70    65.00000  124.50300
   60    56    57    45.00000  109.40800
   60    61    62    35.00000  130.70000
   60    61    63    90.00000  106.19800
   60    70    64    85.00000  110.35700
   60    70    71    40.00000  124.45100
   61    63    64    85.00000  110.35700
   61    63    66    60.00000  126.76000
   63    61    62    40.00000  122.05800
   63    64    65    40.00000  125.70600
   63    64    70   100.00000  107.19100
   63    66    67    50.00000  107.70000
   63    66    68    50.00000  107.70000
   63    66    69    50.00000  107.70000
   64    70    71    45.00000  124.15700
   70    60    61    90.00000  106.19800
   70    64    65    40.00000  125.70600
   66    63    64    65.00000  121.70000
   68    66    67    33.00000  107.80000
   69    66    67    33.00000  107.80000
   69    66    68    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    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  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   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    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    38    58  -0.16000  1.0 1.0
   29    33    38    58  -0.03200 -1.0 2.0
   29    33    38    58   0.04500  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    43   0.56750  1.0 1.0
   29    33    39    43  -0.07550 -1.0 2.0
   29    33    39    43   0.20000  1.0 3.0
   29    33    39    56   0.44750  1.0 1.0
   29    33    39    56  -0.17800 -1.0 2.0
   29    33    39    56   0.20200  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    45   3.62500 -1.0 2.0
   33    38    58    54   3.62500 -1.0 2.0
   33    38    58    59   3.62500 -1.0 2.0
   33    39    43    44   0.30150 -1.0 2.0
   33    39    43    47   1.39750  1.0 1.0
   33    39    43    47  -0.07950 -1.0 2.0
   33    39    43    47  -0.18750  1.0 3.0
   33    39    56    51   0.56750  1.0 1.0
   33    39    56    51  -0.07550 -1.0 2.0
   33    39    56    51   0.20000  1.0 3.0
   33    39    56    57   0.15000  1.0 3.0
   33    39    56    60  -0.03700  1.0 1.0
   33    39    56    60   0.37200 -1.0 2.0
   33    39    56    60  -0.47300  1.0 3.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    58   0.00000  1.0 1.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    43  -0.11250  1.0 3.0
   34    33    39    56   0.15000  1.0 3.0
   38    33    39    40   0.43200  1.0 3.0
   38    33    39    43   0.56750  1.0 1.0
   38    33    39    43  -0.07550 -1.0 2.0
   38    33    39    43   0.20000  1.0 3.0
   38    33    39    56  -0.03700  1.0 1.0
   38    33    39    56   0.37200 -1.0 2.0
   38    33    39    56  -0.47300  1.0 3.0
   38    41    45    46   3.62500 -1.0 2.0
   38    41    45    49   3.62500 -1.0 2.0
   41    38    58    54   3.62500 -1.0 2.0
   41    38    58    59   3.62500 -1.0 2.0
   41    45    49    50   3.62500 -1.0 2.0
   41    45   -49    54   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    54    55   3.62500 -1.0 2.0
   45    49    54    58   3.62500 -1.0 2.0
   46    45    49    50   3.62500 -1.0 2.0
   46    45    49    54   3.62500 -1.0 2.0
   49    54   -58    38   3.62500 -1.0 2.0
   49    54    58    59   3.62500 -1.0 2.0
   50    49    54    55   3.62500 -1.0 2.0
   50    49    54    58   3.62500 -1.0 2.0
   55    54    58    38   3.62500 -1.0 2.0
   55    54    58    59   3.62500 -1.0 2.0
   58    38    41    42   3.62500 -1.0 2.0
   58    38   -41    45   3.62500 -1.0 2.0
   39    33    38    41   0.04150 -1.0 2.0
   39    33    38    58   0.04150 -1.0 2.0
   39    43    47    48   2.45000 -1.0 2.0
   39    43   -47    51   1.49850  1.0 1.0
   39    43   -47    51   1.53950 -1.0 2.0
   39    56    60    61   0.04150 -1.0 2.0
   39    56    60    70   0.39850  1.0 1.0
   39    56    60    70   0.06450 -1.0 2.0
   39    56    60    70   0.32400  1.0 3.0
   40    39    43    44   0.00000  1.0 1.0
   40    39    43    47   0.00000  1.0 1.0
   40    39    56    51   0.15000  1.0 3.0
   40    39    56    57   0.15000  1.0 3.0
   40    39    56    60   0.43200  1.0 3.0
   43    39   -56    51  -0.95700  1.0 1.0
   43    39   -56    51  -0.18200 -1.0 2.0
   43    39   -56    51   0.29450  1.0 3.0
   43    39    56    57  -0.11250  1.0 3.0
   43    39    56    60   0.56750  1.0 1.0
   43    39    56    60  -0.07550 -1.0 2.0
   43    39    56    60   0.20000  1.0 3.0
   43    47    51    52   0.00000  1.0 1.0
   43    47    51    53   0.00000  1.0 1.0
   43    47   -51    56  -0.43950  1.0 1.0
   43    47   -51    56  -0.08100 -1.0 2.0
   43    47   -51    56   0.03350  1.0 3.0
   44    43    47    48   2.45000 -1.0 2.0
   44    43    47    51   3.04450 -1.0 2.0
   47    51   -56    39   0.43900  1.0 1.0
   47    51   -56    39   0.49100 -1.0 2.0
   47    51   -56    39   0.28400  1.0 3.0
   47    51    56    57   0.15000  1.0 3.0
   47    51    56    60   0.08550  1.0 1.0
   47    51    56    60   1.07500 -1.0 2.0
   47    51    56    60  -0.10950  1.0 3.0
   48    47    51    52   0.00000  1.0 1.0
   48    47    51    53   0.00000  1.0 1.0
   48    47    51    56   0.00000  1.0 1.0
   51    56    60    61   0.04150 -1.0 2.0
   51    56    60    70   0.39850  1.0 1.0
   51    56    60    70   0.06450 -1.0 2.0
   51    56    60    70   0.32400  1.0 3.0
   52    51    56    39   0.15000  1.0 3.0
   52    51    56    57   0.15000  1.0 3.0
   52    51    56    60   0.43200  1.0 3.0
   53    51    56    39   0.15000  1.0 3.0
   53    51    56    57   0.15000  1.0 3.0
   53    51    56    60   0.43200  1.0 3.0
   56    39    43    44   0.30150 -1.0 2.0
   56    39   -43    47   1.39750  1.0 1.0
   56    39   -43    47  -0.07950 -1.0 2.0
   56    39   -43    47  -0.18750  1.0 3.0
   56    60    61    62   3.50000 -1.0 2.0
   56    60    61    63   3.50000 -1.0 2.0
   56    60    70    64   3.62500 -1.0 2.0
   56    60    70    71   2.00000 -1.0 2.0
   57    56    60    61   0.00000  1.0 1.0
   57    56    60    70   0.00000  1.0 1.0
   60    61   -63    64   3.62500 -1.0 2.0
   60    61    63    66   3.62500 -1.0 2.0
   61    60   -70    64   3.62500 -1.0 2.0
   61    60    70    71   1.40000 -1.0 2.0
   61    63    64    65   3.62500 -1.0 2.0
   61    63   -64    70   3.62500 -1.0 2.0
   61    63    66    67   0.00000  1.0 1.0
   61    63    66    68   0.00000  1.0 1.0
   61    63    66    69   0.00000  1.0 1.0
   62    61    63    64   3.62500 -1.0 2.0
   62    61    63    66   3.62500 -1.0 2.0
   63    64   -70    60   3.62500 -1.0 2.0
   63    64    70    71   2.00000 -1.0 2.0
   64    63    66    67   0.00000  1.0 1.0
   64    63    66    68   0.00000  1.0 1.0
   64    63    66    69   0.00000  1.0 1.0
   65    64    70    60   3.62500 -1.0 2.0
   65    64    70    71   2.00000 -1.0 2.0
   70    60    61    62   5.37500 -1.0 2.0
   70    60   -61    63   5.37500 -1.0 2.0
   66    63    64    65   3.62500 -1.0 2.0
   66    63    64    70   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
   41    58    38    33   4.00000 -1.0 2.0
   45    42    41    38   1.10000 -1.0 2.0
   49    46    45    41   1.10000 -1.0 2.0
   54    50    49    45   1.10000 -1.0 2.0
   58    55    54    49   1.10000 -1.0 2.0
   54    59    58    38   1.10000 -1.0 2.0
   39    47    43    44  10.50000 -1.0 2.0
   48    43    47    51   1.00000 -1.0 2.0
   61    70    60    56   4.00000 -1.0 2.0
   63    62    61    60   1.10000 -1.0 2.0
   64    66    63    61   4.00000 -1.0 2.0
   70    65    64    63   1.10000 -1.0 2.0
   71    60    70    64   1.00000 -1.0 2.0
END
