* LIGAND DATABASE FILE (OPLS2005)
*
001      75    76    133    205     388
    1     0 S   NP   _N1_     1    28.99464    92.39630   -22.53371
    2     1 S   H    _HN1     2     1.02981    93.06738    46.16030
    3     1 S   H    _H1_     3     1.02835    18.38500  -173.79025
    4     1 S   H    _H2_     4     1.02765   102.15709   -63.31112
    5     1 S   CT   _CA1     5     1.50199   128.11013   165.18578
    6     5 S   HC   _HA1     6     1.09571   105.26424    66.40343
    7     5 S   CO3  _C1_     7     1.53760   112.44765   -53.80575
    8     7 S   O2Z  _O11     8     1.26346   115.00997   -41.80942
    9     7 S   O2Z  _O12     9     1.26243   114.91269   137.38758
   10     5 S   CT   _CB1    10     1.53023   107.28766  -175.72598
   11    10 S   HC   HB11    11     1.09795   109.10395   -51.54386
   12    10 S   HC   HB12    12     1.09778   110.17941    65.03405
   13    10 S   CT   _CG1    13     1.52937   113.12243  -172.98021
   14    13 S   HC   HG11    14     1.09593   110.16321   -64.48528
   15    13 S   HC   HG12    15     1.09630   110.22038    54.67436
   16    13 S   C    _CD1    16     1.51917   112.20988   174.65045
   17    16 S   O    _OE1    17     1.22774   123.28121   -13.94957
   18    16 S   N    _N2_    18     1.38627   111.73980   167.17960
   19    18 S   H    _HN2    19     1.01604   119.05699    -0.38816
   20    18 S   CT1  _CA2    20     1.46127   123.32296  -179.63470
   21    20 S   HC   _HA2    21     1.09596   108.97317   -18.81781
   22    20 S   C    _C2_    22     1.53403   108.40665  -133.88735
   23    22 S   O    _O2_    23     1.23002   122.29570  -146.36063
   24    20 S   CT   _CB2    32     1.53470   111.73550   103.69316
   25    24 S   HC   HB21    33     1.09645   109.64442    56.47279
   26    24 S   HC   HB22    34     1.09556   111.21846   174.14415
   27    22 S   N    _N3_    24     1.38534   113.26893    41.33454
   28    27 S   H    _HN3    25     1.01524   118.93061    -0.85957
   29    24 S   S    _SG2    35     1.82776   114.03129   -63.37758
   30    27 S   CT   _CA3    26     1.45437   123.30733   174.18570
   31    30 S   HC   HA31    27     1.09533   109.01942    28.11696
   32    30 S   HC   HA32    28     1.09484   107.16254   145.17863
   33    29 S   CT   _C20    36     1.81140    99.42557   -74.54775
   34    33 S   HC   _H19    37     1.09260   111.19646    55.66794
   35    33 S   HC   _H20    38     1.09417   110.60993   -64.80187
   36    30 S   CO3  _C3_    29     1.52989   113.36163   -95.11520
   37    36 S   O2Z  _O31    30     1.26390   115.59201   -38.13058
   38    36 S   O2Z  _O32    31     1.26378   114.84242   142.76422
   39    33 S   CO4  _C19    39     1.51342   108.65551   176.16937
   40    39 S   O    _O35    40     1.23279   120.98847    76.63634
   41    39 S   CT   _C11    41     1.52261   116.69017  -104.27402
   42    41 S   HC   _H3_    42     1.09416   108.75680    34.68779
   43    41 S   CT   _C12    43     1.53153   109.23787   -87.04550
   44    43 S   HC   _H12    44     1.09859   110.55239   -68.81066
   45    43 S   HC   _H13    45     1.09831   110.34468    46.97846
   46    41 S   NS   _N4_    57     1.47661   106.99586   153.77795
   47    46 S   H    _H11    58     1.02610   117.50332    62.58576
   48    43 S   CA   _C13    46     1.50872   112.82847   167.94098
   49    46 S   SY   _S1_    59     1.69400   121.13556  -100.33074
   50    49 S   OY   _O33    60     1.45003   108.38006   167.56422
   51    49 S   OY   _O34    61     1.44936   109.95814    34.03155
   52    48 S   CA   _C14    47     1.40202   120.29159   -79.48067
   53    52 S   HA   _H14    48     1.08744   120.36596    -0.07402
   54    49 S   CA   _C8_    62     1.76967   101.54898   -79.96359
   55    52 S   CA   _C15    49     1.39550   120.43540   179.90721
   56    55 S   HA   _H15    50     1.08620   119.94981   180.00000
   57    54 S   CA   _C7_    63     1.39344   119.58843    91.84792
   58    57 S   HA   _H8_    64     1.08465   121.21885    -2.69384
   59    55 S   CA   _C16    51     1.39349   120.05234    -0.18023
   60    59 S   HA   _H16    52     1.08610   120.03049  -179.80820
   61    57 S   CA   _C6_    65     1.39496   119.59059   178.15167
   62    61 S   HA   _H7_    66     1.08713   119.19412   179.57479
   63    59 S   CA   _C17    53     1.39365   119.95347    -0.11535
   64    63 S   HA   _H17    54     1.08622   119.96407  -179.65736
   65    61 S   CA   _C5_    67     1.40051   120.46630     0.20174
   66    48 S   CA   _C18    55     1.40089   120.65044    99.98001
   67    66 S   HA   _H18    56     1.08707   120.43311     0.00000
   68    65 S   CA   _C10    68     1.40122   119.19990    -1.37459
   69    68 S   HA   _H10    69     1.08741   120.25972  -178.86910
   70    65 S   CT   _C4_    72     1.49902   120.38008  -179.09259
   71    70 S   HC   _H4_    73     1.09426   110.01414    88.96770
   72    70 S   HC   _H5_    74     1.09511   110.89146  -150.49661
   73    70 S   HC   _H6_    75     1.09514   110.89252   -31.54694
   74    54 S   CA   _C9_    70     1.39404   119.61443   -90.98033
   75    74 S   HA   _H9_    71     1.08601   121.47971     2.07735
  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   6   5   4   3
   8   4   3   2   1   1  10   4  13   7  12   5   4   8   4   9
   9   4   3   8   4   9   6   3   8   4   5   3   9   3   3   2
   8   1   1   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    46  
   35    39    40    41  
   39    40    41  
   37    38  
   38  
    0  
   40    41    42    43    44    45    48    46    47    49  
   41    42    43    46  
   42    43    44    45    48    52    66    46    47    49    50    51    54  
   43    44    45    48    46    47    49  
   44    45    48    52    53    55    63    66    67    46    47    49  
   45    48    52    66    46  
   48    52    66    46  
   47    49    50    51    54    57    74    48  
   49    50    51    54  
   52    53    55    56    59    63    64    66    67  
   50    51    54    57    58    61    68    74    75  
   51    54    57    74  
   54    57    74  
   53    55    56    59    60    63    66    67  
   55    56    59    66  
   57    58    61    62    65    68    69    74    75  
   56    59    60    63    64    66  
   59    60    63  
   58    61    62    65    68    74    75    70  
   61    62    65    74  
   60    63    64    66    67  
   63    64    66  
   62    65    68    69    74    70    71    72    73  
   65    68    70  
   64    66    67  
   66    67  
   68    69    74    75    70    71    72    73  
   67  
    0  
   69    74    75    70    71    72    73  
   74    75    70  
   71    72    73    74  
   72    73  
   73  
    0  
   75  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   40   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   41   3.5000   0.0660   0.132100   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.073300   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660   0.031700   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.2500   0.1700  -0.652700   1.8100   1.6000   0.054801302  -1.445846770
   47   0.5000   0.0300   0.357200   0.9960   0.8600   0.030040813  -0.651083722
   48   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   49   3.5500   0.2500   0.832700   2.0020   1.7750   0.025682759  -1.666211680
   50   2.9600   0.1700  -0.468000   1.6780   1.4800   0.001000000  -0.126889456
   51   2.9600   0.1700  -0.468000   1.6780   1.4800   0.001000000  -0.126889456
   52   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   54   3.5500   0.0700   0.156700   2.5000   1.7750   0.001000000  -0.843144165
   55   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   56   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   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   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   60   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   61   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   63   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   65   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   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
   70   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   75   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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   317.000  1.522
   39    40   570.000  1.229
   39    41   317.000  1.522
   41    42   340.000  1.090
   41    43   268.000  1.529
   41    46   300.000  1.458
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    48   317.000  1.510
   48    52   469.000  1.400
   48    66   469.000  1.400
   52    53   367.000  1.080
   52    55   469.000  1.400
   55    56   367.000  1.080
   55    59   469.000  1.400
   59    60   367.000  1.080
   59    63   469.000  1.400
   63    64   367.000  1.080
   63    66   469.000  1.400
   66    67   367.000  1.080
   46    47   500.000  1.020
   46    49   245.000  1.722
   49    50   735.000  1.471
   49    51   735.000  1.471
   49    54   225.000  1.779
   54    57   469.000  1.400
   54    74   469.000  1.400
   57    58   367.000  1.080
   57    61   469.000  1.400
   61    62   367.000  1.080
   61    65   469.000  1.400
   65    68   469.000  1.400
   65    70   317.000  1.510
   68    69   367.000  1.080
   68    74   469.000  1.400
   74    75   367.000  1.080
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  110.18000
   33    39    40    80.00000  120.40000
   33    39    41    70.00000  116.00000
   35    33    34    33.00000  107.80000
   39    33    34    35.00000  109.50000
   39    33    35    35.00000  109.50000
   39    41    42    35.00000  109.50000
   39    41    43    63.00000  111.10000
   39    41    46    75.00000  113.29000
   41    39    40    80.00000  120.40000
   41    43    44    37.50000  110.70000
   41    43    45    37.50000  110.70000
   41    43    48    70.00000  112.17500
   41    46    47    45.00000  110.67700
   41    46    49    75.00000  117.08200
   43    41    42    37.50000  110.70000
   43    48    52    70.00000  120.00000
   43    48    66    70.00000  120.00000
   45    43    44    33.00000  107.80000
   48    43    44    35.00000  109.50000
   48    43    45    35.00000  109.50000
   48    52    53    35.00000  120.00000
   48    52    55    63.00000  120.00000
   48    66    63    63.00000  120.00000
   48    66    67    35.00000  120.00000
   52    55    56    35.00000  120.00000
   52    55    59    63.00000  120.00000
   55    52    53    35.00000  120.00000
   55    59    60    35.00000  120.00000
   55    59    63    63.00000  120.00000
   59    55    56    35.00000  120.00000
   59    63    64    35.00000  120.00000
   59    63    66    63.00000  120.00000
   63    59    60    35.00000  120.00000
   63    66    67    35.00000  120.00000
   66    48    52    63.00000  120.00000
   66    63    64    35.00000  120.00000
   46    41    42    50.00000  109.35000
   46    41    43    80.00000  110.21000
   46    49    50   115.00000  107.22500
   46    49    51   115.00000  107.22500
   46    49    54    95.00000  101.59200
   49    46    47    50.00000  110.93800
   49    54    57    65.00000  117.06700
   49    54    74    65.00000  117.06700
   51    49    50   115.00000  120.17200
   54    49    50   100.00000  107.67100
   54    49    51   100.00000  107.67100
   54    57    58    35.00000  120.00000
   54    57    61    63.00000  120.00000
   54    74    68    63.00000  120.00000
   54    74    75    35.00000  120.00000
   57    61    62    35.00000  120.00000
   57    61    65    63.00000  120.00000
   61    57    58    35.00000  120.00000
   61    65    68    63.00000  120.00000
   61    65    70    70.00000  120.00000
   65    61    62    35.00000  120.00000
   65    68    69    35.00000  120.00000
   65    68    74    63.00000  120.00000
   65    70    71    35.00000  109.50000
   65    70    72    35.00000  109.50000
   65    70    73    35.00000  109.50000
   68    74    75    35.00000  120.00000
   74    54    57    63.00000  120.00000
   74    68    69    35.00000  120.00000
   70    65    68    70.00000  120.00000
   72    70    71    33.00000  107.80000
   73    70    71    33.00000  107.80000
   73    70    72    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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    35   0.32350  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    39    40   0.30150 -1.0 2.0
   29    33    39    41   0.65300  1.0 1.0
   29    33    39    41  -0.03850 -1.0 2.0
   29    33    39    41   0.33900  1.0 3.0
   33    39    41    42   0.00000  1.0 1.0
   33    39    41    43   0.60050  1.0 1.0
   33    39    41    43   0.05600 -1.0 2.0
   33    39    41    43   0.26150  1.0 3.0
   33    39    41    46  -0.05600  1.0 1.0
   33    39    41    46   0.24350 -1.0 2.0
   33    39    41    46   1.01150  1.0 3.0
   34    33    39    40   0.00000  1.0 1.0
   34    33    39    41   0.00000  1.0 1.0
   35    33    39    40   0.00000  1.0 1.0
   35    33    39    41   0.00000  1.0 1.0
   39    41    43    44  -0.11250  1.0 3.0
   39    41    43    45  -0.11250  1.0 3.0
   39    41    43    48   0.56750  1.0 1.0
   39    41    43    48  -0.07550 -1.0 2.0
   39    41    43    48   0.20000  1.0 3.0
   39    41    46    47   0.21900  1.0 1.0
   39    41    46    47  -0.24900 -1.0 2.0
   39    41    46    47   0.15200  1.0 3.0
   39    41    46    49   0.23200  1.0 1.0
   39    41    46    49   0.02100 -1.0 2.0
   39    41    46    49   0.24950  1.0 3.0
   40    39    41    42   0.00000  1.0 1.0
   40    39    41    43   0.30150 -1.0 2.0
   40    39    41    46   0.30150 -1.0 2.0
   41    43    48    52   0.04150 -1.0 2.0
   41    43    48    66   0.04150 -1.0 2.0
   41    46    49    50  -0.30400  1.0 1.0
   41    46    49    50   0.50450 -1.0 2.0
   41    46    49    50   0.65550  1.0 3.0
   41    46    49    51  -0.30400  1.0 1.0
   41    46    49    51   0.50450 -1.0 2.0
   41    46    49    51   0.65550  1.0 3.0
   41    46    49    54  -0.64500  1.0 1.0
   41    46    49    54  -1.19050 -1.0 2.0
   41    46    49    54  -0.04400  1.0 3.0
   42    41    43    44   0.15000  1.0 3.0
   42    41    43    45   0.15000  1.0 3.0
   42    41    43    48   0.43200  1.0 3.0
   42    41    46    47   0.07700  1.0 3.0
   42    41    46    49   0.15000  1.0 3.0
   43    41    46    47  -0.34300  1.0 1.0
   43    41    46    47  -0.06000 -1.0 2.0
   43    41    46    49  -0.71500  1.0 1.0
   43    41    46    49  -0.42400 -1.0 2.0
   43    41    46    49   0.18500  1.0 3.0
   43    48    52    53   3.62500 -1.0 2.0
   43    48    52    55   3.62500 -1.0 2.0
   43    48    66    63   3.62500 -1.0 2.0
   43    48    66    67   3.62500 -1.0 2.0
   44    43    48    52   0.00000  1.0 1.0
   44    43    48    66   0.00000  1.0 1.0
   45    43    48    52   0.00000  1.0 1.0
   45    43    48    66   0.00000  1.0 1.0
   48    52    55    56   3.62500 -1.0 2.0
   48    52    55    59   3.62500 -1.0 2.0
   52    48    66    63   3.62500 -1.0 2.0
   52    48    66    67   3.62500 -1.0 2.0
   52    55    59    60   3.62500 -1.0 2.0
   52    55   -59    63   3.62500 -1.0 2.0
   53    52    55    56   3.62500 -1.0 2.0
   53    52    55    59   3.62500 -1.0 2.0
   55    59    63    64   3.62500 -1.0 2.0
   55    59    63    66   3.62500 -1.0 2.0
   56    55    59    60   3.62500 -1.0 2.0
   56    55    59    63   3.62500 -1.0 2.0
   59    63   -66    48   3.62500 -1.0 2.0
   59    63    66    67   3.62500 -1.0 2.0
   60    59    63    64   3.62500 -1.0 2.0
   60    59    63    66   3.62500 -1.0 2.0
   64    63    66    48   3.62500 -1.0 2.0
   64    63    66    67   3.62500 -1.0 2.0
   66    48    52    53   3.62500 -1.0 2.0
   66    48   -52    55   3.62500 -1.0 2.0
   46    41    43    44   0.15000  1.0 3.0
   46    41    43    45   0.15000  1.0 3.0
   46    41    43    48   0.83750  1.0 1.0
   46    41    43    48   0.32200 -1.0 2.0
   46    41    43    48   0.70600  1.0 3.0
   46    49    54    57  -0.49050  1.0 1.0
   46    49    54    57   0.22250 -1.0 2.0
   46    49    54    57  -0.39350  1.0 3.0
   46    49    54    74  -0.49050  1.0 1.0
   46    49    54    74   0.22250 -1.0 2.0
   46    49    54    74  -0.39350  1.0 3.0
   47    46    49    50   1.12100  1.0 1.0
   47    46    49    50   0.54800 -1.0 2.0
   47    46    49    50  -0.29400  1.0 3.0
   47    46    49    51   1.12100  1.0 1.0
   47    46    49    51   0.54800 -1.0 2.0
   47    46    49    51  -0.29400  1.0 3.0
   47    46    49    54   1.01100  1.0 1.0
   47    46    49    54  -0.22250 -1.0 2.0
   47    46    49    54   1.33750  1.0 3.0
   49    54    57    58   3.62500 -1.0 2.0
   49    54    57    61   3.62500 -1.0 2.0
   49    54    74    68   3.62500 -1.0 2.0
   49    54    74    75   3.62500 -1.0 2.0
   50    49    54    57   0.19500  1.0 1.0
   50    49    54    57   0.12000 -1.0 2.0
   50    49    54    74   0.19500  1.0 1.0
   50    49    54    74   0.12000 -1.0 2.0
   51    49    54    57   0.19500  1.0 1.0
   51    49    54    57   0.12000 -1.0 2.0
   51    49    54    74   0.19500  1.0 1.0
   51    49    54    74   0.12000 -1.0 2.0
   54    57    61    62   3.62500 -1.0 2.0
   54    57    61    65   3.62500 -1.0 2.0
   57    54    74    68   3.62500 -1.0 2.0
   57    54    74    75   3.62500 -1.0 2.0
   57    61   -65    68   3.62500 -1.0 2.0
   57    61    65    70   3.62500 -1.0 2.0
   58    57    61    62   3.62500 -1.0 2.0
   58    57    61    65   3.62500 -1.0 2.0
   61    65    68    69   3.62500 -1.0 2.0
   61    65    68    74   3.62500 -1.0 2.0
   61    65    70    71   0.00000  1.0 1.0
   61    65    70    72   0.00000  1.0 1.0
   61    65    70    73   0.00000  1.0 1.0
   62    61    65    68   3.62500 -1.0 2.0
   62    61    65    70   3.62500 -1.0 2.0
   65    68   -74    54   3.62500 -1.0 2.0
   65    68    74    75   3.62500 -1.0 2.0
   68    65    70    71   0.00000  1.0 1.0
   68    65    70    72   0.00000  1.0 1.0
   68    65    70    73   0.00000  1.0 1.0
   69    68    74    54   3.62500 -1.0 2.0
   69    68    74    75   3.62500 -1.0 2.0
   74    54    57    58   3.62500 -1.0 2.0
   74    54   -57    61   3.62500 -1.0 2.0
   70    65    68    69   3.62500 -1.0 2.0
   70    65    68    74   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
   37    30    36    38  10.50000 -1.0 2.0
   33    41    39    40  10.50000 -1.0 2.0
   52    66    48    43   4.00000 -1.0 2.0
   55    53    52    48   1.10000 -1.0 2.0
   59    56    55    52   1.10000 -1.0 2.0
   63    60    59    55   1.10000 -1.0 2.0
   66    64    63    59   1.10000 -1.0 2.0
   63    67    66    48   1.10000 -1.0 2.0
   47    49    46    41   1.00000 -1.0 2.0
   57    74    54    49   4.00000 -1.0 2.0
   61    58    57    54   1.10000 -1.0 2.0
   65    62    61    57   1.10000 -1.0 2.0
   68    70    65    61   4.00000 -1.0 2.0
   74    69    68    65   1.10000 -1.0 2.0
   68    75    74    54   1.10000 -1.0 2.0
END
