* LIGAND DATABASE FILE (OPLS2005)
*
001      69    70    122    191     359
    1     0 S   NP   _N1_     1    28.76729    95.42422   -19.81112
    2     1 S   H    _HN1     2     1.02961    90.77682    27.22322
    3     1 S   H    _H1_     3     1.02840    40.04636   143.25700
    4     1 S   H    _H2_     4     1.02781    79.19754   -81.28744
    5     1 S   CT   _CA1     5     1.50099   149.65452   162.79247
    6     5 S   HC   _HA1     6     1.09565   105.28820    45.86598
    7     5 S   CO3  _C1_     7     1.53824   112.40276   -74.51653
    8     7 S   O2Z  _O11     8     1.26363   115.02331   -43.07540
    9     7 S   O2Z  _O12     9     1.26231   114.97573   136.38007
   10     5 S   CT   _CB1    10     1.53118   107.46332   163.94859
   11    10 S   HC   HB11    11     1.09817   109.52714   -49.53119
   12    10 S   HC   HB12    12     1.09827   110.32840    67.08448
   13    10 S   CT   _CG1    13     1.52994   112.61803  -170.61957
   14    13 S   HC   HG11    14     1.09528   110.40528   -59.77667
   15    13 S   HC   HG12    15     1.09632   110.10310    59.34708
   16    13 S   C    _CD1    16     1.51784   112.27165   179.66138
   17    16 S   O    _OE1    17     1.22714   123.23071   -10.05899
   18    16 S   N    _N2_    18     1.38578   111.61465   170.41959
   19    18 S   H    _HN2    19     1.01600   119.01840     1.18234
   20    18 S   CT1  _CA2    20     1.46243   123.51294  -178.38069
   21    20 S   HC   _HA2    21     1.09730   109.40054   -14.19068
   22    20 S   C    _C2_    22     1.53419   108.31351  -129.90690
   23    22 S   O    _O2_    23     1.23008   122.26439  -146.08950
   24    20 S   CT   _CB2    32     1.53402   111.13383   107.98058
   25    24 S   HC   HB21    33     1.09491   109.55825    53.43468
   26    24 S   HC   HB22    34     1.09504   110.77059   172.22964
   27    22 S   N    _N3_    24     1.38519   113.34481    41.34255
   28    27 S   H    _HN3    25     1.01528   118.91489    -0.62275
   29    24 S   S    _SG2    35     1.82854   111.69181   -68.36604
   30    27 S   CT   _CA3    26     1.45455   123.46590   175.08406
   31    30 S   HC   HA31    27     1.09522   109.25710    23.88211
   32    30 S   HC   HA32    28     1.09497   107.11126   140.89441
   33    29 S   CT   _C17    36     1.83849    99.61850   161.92197
   34    33 S   HC   _H3_    37     1.09369   107.24138    35.98124
   35    30 S   CO3  _C3_    29     1.52929   113.12403   -99.60901
   36    35 S   O2Z  _O31    30     1.26406   115.41632   -43.94093
   37    35 S   O2Z  _O32    31     1.26360   114.97449   136.99938
   38    33 S   CO4  _C13    38     1.51774   107.81468   -81.04469
   39    38 S   O    _O18    39     1.23033   121.45601    96.45394
   40    38 S   CM   _C11    40     1.49278   118.09769   -81.90331
   41    40 S   CM   _C10    41     1.33679   120.29667   -14.60845
   42    41 S   HC   _H26    42     1.08480   121.10522   179.85463
   43    40 S   OS   _O19    65     1.38215   119.04800   168.30420
   44    41 S   CO4  _C12    43     1.48111   122.05583    -0.12972
   45    44 S   O    _O17    44     1.23007   119.30031   169.73569
   46    43 S   CT   _C18    66     1.42677   110.88024   -74.32599
   47    46 S   HC   _H32    67     1.09390   107.93626  -174.10136
   48    46 S   HC   _H33    68     1.09454   111.37634    67.44437
   49    46 S   HC   _H34    69     1.09551   110.96170   -55.74202
   50    33 S   CT   _C16    45     1.54229   111.16257   156.51487
   51    50 S   HC   _H30    46     1.09927   108.61411   -46.02290
   52    50 S   CT   _C19    47     1.56511   112.72530  -167.05638
   53    52 S   HC   _H35    48     1.09965   107.08184   -62.03929
   54    52 S   CA   _C9_    49     1.52494   113.07465    56.24380
   55    52 S   CM   _C15    60     1.51756   111.82496  -179.54200
   56    55 S   HC   _H29    61     1.08802   117.66555   -57.17170
   57    54 S   CA   _C7_    50     1.40410   119.70522  -124.47029
   58    57 S   HA   _H24    51     1.08742   120.49521     0.08847
   59    55 S   CM   _C14    62     1.33878   124.04889   122.03754
   60    59 S   HC   _H27    63     1.08477   120.42596  -179.55677
   61    59 S   HC   _H28    64     1.08444   121.68651     0.44235
   62    57 S   CA   _C5_    52     1.39606   120.66848   179.87333
   63    62 S   HA   _H22    53     1.08632   119.92010  -179.80119
   64    62 S   CA   _C4_    54     1.39291   120.10176     0.21761
   65    64 S   HA   _H21    55     1.08613   120.04304   180.00000
   66    64 S   CA   _C6_    56     1.39292   119.91055     0.12033
   67    66 S   HA   _H23    57     1.08633   119.96802   179.78878
   68    54 S   CA   _C8_    58     1.40455   121.73283    55.95332
   69    68 S   HA   _H25    59     1.08702   120.63250     0.19782
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  14   7   2   1   1  10   4  10   8   4   5   7   3   3   2   1
   1   9   4  13   6  12   6   3   8   4   2   1   1   6   3   5
   3   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    50    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    44    50    51    52  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    44    45    50    51    52    53    54    55    43  
   38    39    40    44    50    51    52  
   36    37  
   37  
    0  
   39    40    41    42    44    50    51    52    43    46  
   40    41    50    43  
   41    42    44    45    50    43    46    47    48    49  
   42    44    45    50    51    52    43    46  
   44    45    50    43  
   46    47    48    49    44  
   45    50    51    52    53    54    55  
   50    51    52  
   47    48    49  
   48    49  
   49  
    0  
   51    52    53    54    57    68    55    56    59  
   52    53    54    55  
   53    54    57    58    62    66    68    69    55    56    59    60    61  
   54    57    68    55    56    59  
   57    58    62    63    64    66    67    68    69    55    56    59  
   56    59    60    61    57    68  
   59    60    61  
   58    62    63    64    65    66    68    69  
   62    63    64    68  
   60    61  
   61  
    0  
   63    64    65    66    67    68  
   64    65    66  
   65    66    67    68    69  
   66    67    68  
   67    68    69  
   68    69  
   69  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.4200   0.0150   0.060000   1.3810   1.2100   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   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   39   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   40   3.5500   0.0760   0.085000   2.0020   1.7750   0.023028004  -0.852763146
   41   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   42   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   43   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   44   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   46   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660   0.055000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   55   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   60   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   61   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   64   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   65   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   66   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   67   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   68   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   69   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   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    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  1.522
   33    50   268.000  1.529
   38    39   570.000  1.229
   38    40   320.000  1.462
   40    41   549.000  1.340
   40    43   440.000  1.360
   41    42   340.000  1.080
   41    44   320.000  1.462
   44    45   570.000  1.229
   44    50   317.000  1.522
   50    51   340.000  1.090
   50    52   268.000  1.529
   52    53   340.000  1.090
   52    54   317.000  1.510
   52    55   317.000  1.510
   54    57   469.000  1.400
   54    68   469.000  1.400
   57    58   367.000  1.080
   57    62   469.000  1.400
   62    63   367.000  1.080
   62    64   469.000  1.400
   64    65   367.000  1.080
   64    66   469.000  1.400
   66    67   367.000  1.080
   66    68   469.000  1.400
   68    69   367.000  1.080
   55    56   340.000  1.080
   55    59   549.000  1.340
   59    60   340.000  1.080
   59    61   340.000  1.080
   43    46   320.000  1.410
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    49   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    75.00000  110.18000
   29    33    50    75.00000  111.63000
   33    38    39    80.00000  120.40000
   33    38    40    65.00000  118.62400
   33    50    44    63.00000  111.10000
   33    50    51    37.50000  110.70000
   33    50    52    58.35000  112.70000
   38    33    34    35.00000  109.50000
   38    40    41    65.00000  118.96000
   38    40    43    85.00000  116.28000
   40    38    39    80.00000  123.72100
   40    41    42    35.00000  120.00000
   40    41    44    65.00000  118.96000
   40    43    46    90.00000  111.18400
   41    44    45    80.00000  123.72100
   41    44    50    65.00000  118.62400
   44    41    42    40.00000  117.72500
   44    50    51    35.00000  109.50000
   44    50    52    63.00000  111.10000
   50    33    34    37.50000  110.70000
   50    33    38    63.00000  111.10000
   50    44    45    80.00000  120.40000
   50    52    53    37.50000  110.70000
   50    52    54    70.00000  112.17500
   50    52    55    70.00000  112.02700
   52    50    51    37.50000  110.70000
   52    54    57    70.00000  120.00000
   52    54    68    70.00000  120.00000
   52    55    56    35.00000  117.00000
   52    55    59    70.00000  124.00000
   54    52    53    35.00000  109.50000
   54    57    58    35.00000  120.00000
   54    57    62    63.00000  120.00000
   54    68    66    63.00000  120.00000
   54    68    69    35.00000  120.00000
   57    62    63    35.00000  120.00000
   57    62    64    63.00000  120.00000
   62    57    58    35.00000  120.00000
   62    64    65    35.00000  120.00000
   62    64    66    63.00000  120.00000
   64    62    63    35.00000  120.00000
   64    66    67    35.00000  120.00000
   64    66    68    63.00000  120.00000
   66    64    65    35.00000  120.00000
   66    68    69    35.00000  120.00000
   68    54    57    63.00000  120.00000
   68    66    67    35.00000  120.00000
   55    52    53    35.00000  109.50000
   55    52    54    70.00000  112.99600
   55    59    60    35.00000  120.00000
   55    59    61    35.00000  120.00000
   59    55    56    35.00000  120.00000
   61    59    60    35.00000  117.00000
   43    40    41    80.00000  120.01400
   43    46    47    35.00000  109.50000
   43    46    48    35.00000  109.50000
   43    46    49    35.00000  109.50000
   48    46    47    33.00000  107.80000
   49    46    47    33.00000  107.80000
   49    46    48    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   0.01700  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    50   0.01700  1.0 1.0
   24    29    33    50  -0.23550 -1.0 2.0
   24    29    33    50   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   0.30150 -1.0 2.0
   29    33    38    40   0.65300  1.0 1.0
   29    33    38    40  -0.03850 -1.0 2.0
   29    33    38    40   0.33900  1.0 3.0
   29    33    50    44   0.56750  1.0 1.0
   29    33    50    44  -0.07550 -1.0 2.0
   29    33    50    44   0.20000  1.0 3.0
   29    33    50    51   0.15000  1.0 3.0
   29    33    50    52   0.44750  1.0 1.0
   29    33    50    52  -0.17800 -1.0 2.0
   29    33    50    52   0.20200  1.0 3.0
   33    38    40    41  -0.33500  1.0 1.0
   33    38    40    41   1.06600 -1.0 2.0
   33    38    40    41  -0.14000  1.0 3.0
   33    38    40    43   0.32450 -1.0 2.0
   33    38    40    43   0.17400  1.0 3.0
   33    50    52    53   0.15000  1.0 3.0
   33    50    52    54  -0.03700  1.0 1.0
   33    50    52    54   0.37200 -1.0 2.0
   33    50    52    54  -0.47300  1.0 3.0
   33    50    52    55   0.34400  1.0 1.0
   33    50    52    55   0.09450 -1.0 2.0
   33    50    52    55   0.11100  1.0 3.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    50    44  -0.11250  1.0 3.0
   34    33    50    51   0.15000  1.0 3.0
   34    33    50    52   0.15000  1.0 3.0
   38    33    50    44   0.11950  1.0 1.0
   38    33    50    44   0.20300 -1.0 2.0
   38    33    50    44  -0.70800  1.0 3.0
   38    33    50    51  -0.11250  1.0 3.0
   38    33    50    52  -0.95700  1.0 1.0
   38    33    50    52  -0.18200 -1.0 2.0
   38    33    50    52   0.29450  1.0 3.0
   38    40    41    42   7.00000 -1.0 2.0
   38    40   -41    44   7.00000 -1.0 2.0
   38    40    43    46   0.15100 -1.0 2.0
   39    38    40    41   1.00000 -1.0 2.0
   39    38    40    43  -0.11900  1.0 1.0
   39    38    40    43   0.76850 -1.0 2.0
   39    38    40    43   0.14100  1.0 3.0
   40    41    44    45   1.00000 -1.0 2.0
   40    41    44    50  -0.33500  1.0 1.0
   40    41    44    50   1.06600 -1.0 2.0
   40    41    44    50  -0.14000  1.0 3.0
   40    43    46    47   0.08050  1.0 3.0
   40    43    46    48   0.08050  1.0 3.0
   40    43    46    49   0.08050  1.0 3.0
   41    40    43    46  -2.26850  1.0 1.0
   41    40    43    46   3.39050 -1.0 2.0
   41    44   -50    33   0.65300  1.0 1.0
   41    44   -50    33  -0.03850 -1.0 2.0
   41    44   -50    33   0.33900  1.0 3.0
   41    44    50    51   0.00000  1.0 1.0
   41    44    50    52   0.65300  1.0 1.0
   41    44    50    52  -0.03850 -1.0 2.0
   41    44    50    52   0.33900  1.0 3.0
   42    41    44    45   0.00000  1.0 1.0
   42    41    44    50   0.04550  1.0 1.0
   42    41    44    50   0.83000 -1.0 2.0
   42    41    44    50  -0.04000  1.0 3.0
   44    50    52    53  -0.11250  1.0 3.0
   44    50    52    54   0.56750  1.0 1.0
   44    50    52    54  -0.07550 -1.0 2.0
   44    50    52    54   0.20000  1.0 3.0
   44    50    52    55  -0.98800  1.0 1.0
   44    50    52    55   0.48800 -1.0 2.0
   44    50    52    55   0.76800  1.0 3.0
   45    44    50    33   0.30150 -1.0 2.0
   45    44    50    51   0.00000  1.0 1.0
   45    44    50    52   0.30150 -1.0 2.0
   50    33    38    39   0.30150 -1.0 2.0
   50    33   -38    40   0.65300  1.0 1.0
   50    33   -38    40  -0.03850 -1.0 2.0
   50    33   -38    40   0.33900  1.0 3.0
   50    52    54    57   0.04150 -1.0 2.0
   50    52    54    68   0.04150 -1.0 2.0
   50    52    55    56   0.00000  1.0 1.0
   50    52    55    59   0.09850  1.0 1.0
   50    52    55    59   0.15250 -1.0 2.0
   50    52    55    59  -0.50650  1.0 3.0
   51    50    52    53   0.15000  1.0 3.0
   51    50    52    54   0.43200  1.0 3.0
   51    50    52    55   0.15000  1.0 3.0
   52    54    57    58   3.62500 -1.0 2.0
   52    54    57    62   3.62500 -1.0 2.0
   52    54    68    66   3.62500 -1.0 2.0
   52    54    68    69   3.62500 -1.0 2.0
   52    55    59    60   7.00000 -1.0 2.0
   52    55    59    61   7.00000 -1.0 2.0
   53    52    54    57   0.00000  1.0 1.0
   53    52    54    68   0.00000  1.0 1.0
   53    52    55    56   0.33100  1.0 3.0
   53    52    55    59   0.00000  1.0 1.0
   54    52    55    56   0.00000  1.0 1.0
   54    52    55    59   1.44450  1.0 1.0
   54    52    55    59   0.06600 -1.0 2.0
   54    52    55    59   0.29250  1.0 3.0
   54    57    62    63   3.62500 -1.0 2.0
   54    57    62    64   3.62500 -1.0 2.0
   57    54    68    66   3.62500 -1.0 2.0
   57    54    68    69   3.62500 -1.0 2.0
   57    62    64    65   3.62500 -1.0 2.0
   57    62   -64    66   3.62500 -1.0 2.0
   58    57    62    63   3.62500 -1.0 2.0
   58    57    62    64   3.62500 -1.0 2.0
   62    64    66    67   3.62500 -1.0 2.0
   62    64    66    68   3.62500 -1.0 2.0
   63    62    64    65   3.62500 -1.0 2.0
   63    62    64    66   3.62500 -1.0 2.0
   64    66   -68    54   3.62500 -1.0 2.0
   64    66    68    69   3.62500 -1.0 2.0
   65    64    66    67   3.62500 -1.0 2.0
   65    64    66    68   3.62500 -1.0 2.0
   67    66    68    54   3.62500 -1.0 2.0
   67    66    68    69   3.62500 -1.0 2.0
   68    54    57    58   3.62500 -1.0 2.0
   68    54   -57    62   3.62500 -1.0 2.0
   55    52    54    57   0.18050 -1.0 2.0
   55    52    54    68   0.18050 -1.0 2.0
   56    55    59    60   7.00000 -1.0 2.0
   56    55    59    61   7.00000 -1.0 2.0
   43    40    41    42   7.00000 -1.0 2.0
   43    40    41    44   7.00000 -1.0 2.0
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
   37    30    35    36  10.50000 -1.0 2.0
   33    40    38    39  10.50000 -1.0 2.0
   38    43    40    41   1.10000 -1.0 2.0
   44    42    41    40   1.10000 -1.0 2.0
   41    50    44    45  10.50000 -1.0 2.0
   57    68    54    52   4.00000 -1.0 2.0
   62    58    57    54   1.10000 -1.0 2.0
   64    63    62    57   1.10000 -1.0 2.0
   66    65    64    62   1.10000 -1.0 2.0
   68    67    66    64   1.10000 -1.0 2.0
   66    69    68    54   1.10000 -1.0 2.0
   52    56    55    59  15.00000 -1.0 2.0
   60    61    59    55  15.00000 -1.0 2.0
END
