* LIGAND DATABASE FILE (OPLS2005)
*
001      70    72    132    202     383
    1     0 S   NP   _N1_     1    29.47620    94.04405   -24.89392
    2     1 S   H    _HN1     2     1.02782   108.19773  -113.45912
    3     1 S   H    _H1_     3     1.02955    90.90276    -3.76718
    4     1 S   H    _H2_     4     1.02825    17.40733   154.56058
    5     1 S   CT   _CA1     5     1.50142   124.15202   111.77196
    6     5 S   HC   _HA1     6     1.09570   105.18354    71.81407
    7     5 S   CO3  _C1_     7     1.53826   112.52954   -48.32877
    8     7 S   O2Z  _O11     8     1.26371   115.03550   -38.95087
    9     7 S   O2Z  _O12     9     1.26243   114.97597   140.12460
   10     5 S   CT   _CB1    10     1.53046   107.36029  -170.19781
   11    10 S   HC   HB11    11     1.09832   109.42660   -49.22840
   12    10 S   HC   HB12    12     1.09765   110.32853    67.27977
   13    10 S   CT   _CG1    13     1.52967   112.71901  -170.22322
   14    13 S   HC   HG11    14     1.09584   110.57017   -64.24523
   15    13 S   HC   HG12    15     1.09648   109.92135    55.11212
   16    13 S   C    _CD1    16     1.51691   112.19032   175.66049
   17    16 S   O    _OE1    17     1.22711   123.29223     3.81988
   18    16 S   N    _N2_    18     1.38628   111.77860  -176.38578
   19    18 S   H    _HN2    19     1.01563   119.11623     3.77190
   20    18 S   CT1  _CA2    20     1.46104   123.23226  -177.88234
   21    20 S   HC   _HA2    21     1.09519   109.00601     6.75653
   22    20 S   C    _C2_    22     1.53516   109.61741  -108.48373
   23    22 S   O    _O2_    23     1.23087   122.11716  -150.42549
   24    20 S   CT   _CB2    32     1.53427   111.65050   128.62719
   25    24 S   HC   HB21    33     1.09681   109.28114    68.14877
   26    24 S   HC   HB22    34     1.09462   110.98645  -175.16171
   27    22 S   N    _N3_    24     1.38275   113.92072    37.11374
   28    27 S   H    _HN3    25     1.01562   119.62945    -3.45423
   29    24 S   S    _SG2    35     1.82902   114.79981   -50.63981
   30    27 S   CT   _CA3    26     1.45278   123.16541   176.92910
   31    30 S   HC   HA31    27     1.09552   107.52860   -63.80293
   32    30 S   HC   HA32    28     1.09557   107.95768    52.62048
   33    29 S   CT   _C10    36     1.85423   101.20951   -66.12073
   34    33 S   HC   _H4_    37     1.08692   103.46548    52.22620
   35    30 S   CO3  _C3_    29     1.52945   114.11154   174.59709
   36    35 S   O2Z  _O31    30     1.26369   116.08193    -0.98516
   37    35 S   O2Z  _O32    31     1.26429   114.40511   179.07613
   38    33 S   CT   _C9_    38     1.53324   109.21014   167.56502
   39    38 S   HC   _H3_    39     1.09765   110.07596    35.01014
   40    33 S   CT   _C11    58     1.55087   120.01902   -72.07836
   41    40 S   OM   _O36    59     1.32076   113.12956   -21.15621
   42    38 S   C5BC _C8_    40     1.51402   115.35111   -87.89897
   43    40 S   CO4  _C18    60     1.52206   103.64679  -134.16497
   44    43 S   O    _O34    61     1.22479   126.46013  -176.28316
   45    42 S   C5BC _C5_    41     1.44441   123.68977   114.31025
   46    38 S   OS   _O35    62     1.43366   106.80245   147.06659
   47    45 S   C5A  _C6_    42     1.37469   106.21331   179.74436
   48    47 S   HA   _H8_    43     1.08060   133.47460   179.93744
   49    45 S   CT   _C4_    67     1.48434   127.91351    -0.24549
   50    49 S   HC   _H5_    68     1.09409   110.59641   -61.33630
   51    49 S   HC   _H6_    69     1.09454   110.55528    59.05557
   52    49 S   HC   _H7_    70     1.09504   111.28434   178.85465
   53    47 S   OA   _O33    44     1.34756   110.89511     0.12511
   54    42 S   C5A  _C7_    45     1.39854   131.10536   -65.87771
   55    54 S   CT   _C16    46     1.50213   138.17496     2.15186
   56    55 S   HC   _H14    47     1.09848   107.34905   109.89997
   57    55 S   HC   _H15    48     1.09874   108.55443  -137.62536
   58    55 S   CM   _C15    49     1.50789   117.61102   -14.12709
   59    58 S   CM   _C14    50     1.34679   118.64232    90.81129
   60    59 S   HC   _H13    51     1.09001   117.94206     6.99126
   61    58 S   CT   _C17    63     1.50345   115.17788   -86.72837
   62    61 S   HC   _H16    64     1.09554   109.51933   -65.58427
   63    61 S   HC   _H17    65     1.09143   113.60916   174.82994
   64    61 S   HC   _H18    66     1.09405   111.00196    53.21894
   65    59 S   CT   _C13    52     1.49543   127.91361  -164.16487
   66    65 S   HC   _H11    53     1.09689   108.39382  -129.90999
   67    65 S   HC   _H12    54     1.09282   112.41224   -13.54407
   68    65 S   CT   _C12    55     1.55088   112.31624   110.12190
   69    68 S   HC   _H9_    56     1.09906   108.31309    71.63339
   70    68 S   HC   _H10    57     1.10143   105.55413  -176.32454
  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  10   5   4   3
  15   8   2   1   1  14   6  12   7  15   6   2  10   2   8   3
   5   2   1   1   5   6  10   4   3  10  11   5   4   2   1   1
   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    42    68    40    41    43    46  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    45    54    65    68    69    70    40    41    43    44    46  
   38    39    42    68    40    41    43    46  
   36    37  
   37  
    0  
   39    42    45    47    53    54    55    68    40    41    43    44    46    49  
   42    45    54    40    43    46  
   41    43    44    46    42    59    65    66    67    68    69    70  
   43    44    46    65    68    69    70  
   45    47    48    53    54    55    56    57    58    43    46    49    50    51    52  
   44    46    65    68    69    70  
   46    68  
   47    48    53    54    55    46    49    50    51    52  
   54    68  
   48    53    54    55    49    50    51    52  
   53    54    49  
   50    51    52    53    54  
   51    52  
   52  
    0  
   54    55    56    57    58  
   55    56    57    58    59    61  
   56    57    58    59    60    65    61    62    63    64  
   57    58    59    61  
   58    59    61  
   59    60    65    66    67    68    61    62    63    64  
   60    65    66    67    68    69    70    61    62    63    64  
   65    66    67    68    61  
   62    63    64    65  
   63    64  
   64  
    0  
   66    67    68    69    70  
   67    68    69    70  
   68    69    70  
   69    70  
   70  
    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   2.5000   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   3.5000   0.0660   0.335000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   40   4.2000   0.3000  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   41   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5500   0.0760  -0.143000   2.5000   1.7750   0.001000000  -0.843144165
   43   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   45   3.5500   0.0760  -0.143000   2.0020   1.7750   0.001000000  -0.843144165
   46   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   47   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   48   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   49   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.9000   0.1400  -0.190000   1.6450   1.4500   0.001000000  -0.126889456
   54   3.5500   0.0700   0.008000   2.5000   1.7750   0.001000000  -0.843144165
   55   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   59   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   60   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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   268.000  1.529
   33    40   268.000  1.529
   38    39   340.000  1.090
   38    42   285.000  1.502
   38    46   320.000  1.410
   42    45   469.000  1.424
   42    54   546.000  1.367
   45    47   546.000  1.367
   45    49   285.000  1.502
   47    48   367.000  1.080
   47    53   340.000  1.360
   53    54   340.000  1.360
   54    55   295.000  1.489
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   317.000  1.510
   58    59   549.000  1.340
   58    61   317.000  1.510
   59    60   340.000  1.080
   59    65   317.000  1.510
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   268.000  1.529
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    40   268.000  1.529
   40    41   570.000  1.307
   40    43   317.000  1.522
   43    44   570.000  1.229
   43    46   214.000  1.327
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   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  111.63000
   29    33    40    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    42    70.00000  112.17500
   33    38    46    50.00000  109.50000
   33    40    68    58.35000  112.70000
   33    40    41    50.00000  109.50000
   33    40    43    63.00000  111.10000
   38    33    34    37.50000  110.70000
   38    42    45    60.00000  130.00000
   38    42    54    60.00000  130.00000
   38    46    43    83.00000  116.90000
   42    38    39    35.00000  109.50000
   42    45    47    70.00000  107.30000
   42    45    49    60.00000  130.00000
   42    54    53    70.00000  110.60000
   42    54    55    50.00000  133.50000
   45    47    48    35.00000  132.10000
   45    47    53    70.00000  110.60000
   45    49    50    35.00000  109.50000
   45    49    51    35.00000  109.50000
   45    49    52    35.00000  109.50000
   47    53    54    70.00000  106.50000
   53    47    48    35.00000  113.40000
   53    54    55    80.00000  116.10000
   54    42    45    70.00000  107.30000
   54    55    56    45.00000  110.47400
   54    55    57    45.00000  110.47400
   54    55    58    70.00000  112.40000
   55    58    59    70.00000  124.00000
   55    58    61    65.00000  117.92700
   57    55    56    33.00000  107.80000
   58    55    56    35.00000  109.50000
   58    55    57    35.00000  109.50000
   58    59    60    35.00000  120.00000
   58    59    65    70.00000  124.00000
   58    61    62    35.00000  109.50000
   58    61    63    35.00000  109.50000
   58    61    64    35.00000  109.50000
   59    65    66    35.00000  109.50000
   59    65    67    35.00000  109.50000
   59    65    68    70.00000  112.02700
   65    59    60    35.00000  117.00000
   65    68    69    37.50000  110.70000
   65    68    70    37.50000  110.70000
   65    68    40    58.35000  112.70000
   67    65    66    33.00000  107.80000
   68    65    66    37.50000  110.70000
   68    65    67    37.50000  110.70000
   68    40    41    50.00000  109.50000
   68    40    43    63.00000  111.10000
   70    68    69    33.00000  107.80000
   40    33    34    37.50000  110.70000
   40    33    38    58.35000  112.70000
   40    68    69    37.50000  110.70000
   40    68    70    37.50000  110.70000
   40    43    44    80.00000  120.40000
   40    43    46    81.00000  111.40000
   43    40    41    90.00000  108.74100
   46    38    39    35.00000  109.50000
   46    38    42    85.00000  111.85700
   46    43    44    83.00000  123.40000
   61    58    59    70.00000  124.00000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
   49    45    47    60.00000  130.00000
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    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    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    42   0.56750  1.0 1.0
   29    33    38    42  -0.07550 -1.0 2.0
   29    33    38    42   0.20000  1.0 3.0
   29    33    38    46   0.56750  1.0 1.0
   29    33    38    46  -0.07550 -1.0 2.0
   29    33    38    46   0.20000  1.0 3.0
   29    33    40    68   0.44750  1.0 1.0
   29    33    40    68  -0.17800 -1.0 2.0
   29    33    40    68   0.20200  1.0 3.0
   29    33    40    41   0.56750  1.0 1.0
   29    33    40    41  -0.07550 -1.0 2.0
   29    33    40    41   0.20000  1.0 3.0
   29    33    40    43   0.56750  1.0 1.0
   29    33    40    43  -0.07550 -1.0 2.0
   29    33    40    43   0.20000  1.0 3.0
   33    38    42    45   0.04150 -1.0 2.0
   33    38    42    54   0.04150 -1.0 2.0
   33    38   -46    43  -0.25900  1.0 1.0
   33    38   -46    43  -0.47000 -1.0 2.0
   33    38   -46    43   0.11750  1.0 3.0
   33    40    43    44   0.30150 -1.0 2.0
   33    40   -43    46   0.36750  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    42   0.43200  1.0 3.0
   34    33    38    46   0.23400  1.0 3.0
   34    33    40    68   0.15000  1.0 3.0
   34    33    40    41   0.23400  1.0 3.0
   34    33    40    43  -0.11250  1.0 3.0
   38    33    40    68   0.56750  1.0 1.0
   38    33    40    68  -0.07550 -1.0 2.0
   38    33    40    68   0.20000  1.0 3.0
   38    33    40    41   0.62750  1.0 1.0
   38    33    40    41  -0.30950 -1.0 2.0
   38    33    40    41   0.27300  1.0 3.0
   38    33   -40    43  -0.95700  1.0 1.0
   38    33   -40    43  -0.18200 -1.0 2.0
   38    33   -40    43   0.29450  1.0 3.0
   38    42    45    47   3.62500 -1.0 2.0
   38    42    45    49   3.62500 -1.0 2.0
   38    42    54    53   3.62500 -1.0 2.0
   38    42    54    55   3.62500 -1.0 2.0
   39    38    42    45   0.00000  1.0 1.0
   39    38    42    54   0.00000  1.0 1.0
   39    38    46    43   0.08050  1.0 3.0
   42    38    46    43  -0.43900 -1.0 2.0
   42    38    46    43   0.14100  1.0 3.0
   42    45    47    48   3.62500 -1.0 2.0
   42    45   -47    53   3.62500 -1.0 2.0
   42    45    49    50   0.00000  1.0 1.0
   42    45    49    51   0.00000  1.0 1.0
   42    45    49    52   0.00000  1.0 1.0
   42    54    55    56   0.00000  1.0 1.0
   42    54    55    57   0.00000  1.0 1.0
   42    54    55    58   0.18050 -1.0 2.0
   45    42   -54    53   3.62500 -1.0 2.0
   45    42    54    55   3.62500 -1.0 2.0
   45    47   -53    54   3.62500 -1.0 2.0
   47    45    49    50   0.00000  1.0 1.0
   47    45    49    51   0.00000  1.0 1.0
   47    45    49    52   0.00000  1.0 1.0
   47    53   -54    42   3.62500 -1.0 2.0
   47    53    54    55   3.62500 -1.0 2.0
   48    47    53    54   3.62500 -1.0 2.0
   53    54    55    56   0.00000  1.0 1.0
   53    54    55    57   0.00000  1.0 1.0
   53    54    55    58   0.04300 -1.0 2.0
   54    42   -45    47   3.62500 -1.0 2.0
   54    42    45    49   3.62500 -1.0 2.0
   54    55    58    59   1.44450  1.0 1.0
   54    55    58    59   0.06600 -1.0 2.0
   54    55    58    59   0.29250  1.0 3.0
   54    55    58    61   0.09700  1.0 1.0
   54    55    58    61   0.15600 -1.0 2.0
   54    55    58    61  -0.50800  1.0 3.0
   55    58    59    60   7.00000 -1.0 2.0
   55    58    59    65   7.00000 -1.0 2.0
   55    58    61    62   0.34800  1.0 3.0
   55    58    61    63   0.34800  1.0 3.0
   55    58    61    64   0.34800  1.0 3.0
   56    55    58    59   0.00000  1.0 1.0
   56    55    58    61   0.34800  1.0 3.0
   57    55    58    59   0.00000  1.0 1.0
   57    55    58    61   0.34800  1.0 3.0
   58    59    65    66   0.00000  1.0 1.0
   58    59    65    67   0.00000  1.0 1.0
   58    59    65    68   0.09850  1.0 1.0
   58    59    65    68   0.15250 -1.0 2.0
   58    59    65    68  -0.50650  1.0 3.0
   59    58    61    62   0.00000  1.0 1.0
   59    58    61    63   0.00000  1.0 1.0
   59    58    61    64   0.00000  1.0 1.0
   59    65    68    69   0.15000  1.0 3.0
   59    65    68    70   0.15000  1.0 3.0
   59    65    68    40   0.34400  1.0 1.0
   59    65    68    40   0.09450 -1.0 2.0
   59    65    68    40   0.11100  1.0 3.0
   60    59    65    66   0.33100  1.0 3.0
   60    59    65    67   0.33100  1.0 3.0
   60    59    65    68   0.00000  1.0 1.0
   65    68    40    33   0.56750  1.0 1.0
   65    68    40    33  -0.07550 -1.0 2.0
   65    68    40    33   0.20000  1.0 3.0
   65    68    40    41   0.62750  1.0 1.0
   65    68    40    41  -0.30950 -1.0 2.0
   65    68    40    41   0.27300  1.0 3.0
   65    68    40    43  -0.95700  1.0 1.0
   65    68    40    43  -0.18200 -1.0 2.0
   65    68    40    43   0.29450  1.0 3.0
   66    65    68    69   0.15000  1.0 3.0
   66    65    68    70   0.15000  1.0 3.0
   66    65    68    40   0.15000  1.0 3.0
   67    65    68    69   0.15000  1.0 3.0
   67    65    68    70   0.15000  1.0 3.0
   67    65    68    40   0.15000  1.0 3.0
   68    40    43    44   0.30150 -1.0 2.0
   68    40    43    46   0.36750  1.0 3.0
   69    68    40    33   0.15000  1.0 3.0
   69    68    40    41   0.23400  1.0 3.0
   69    68    40    43  -0.11250  1.0 3.0
   70    68    40    33   0.15000  1.0 3.0
   70    68    40    41   0.23400  1.0 3.0
   70    68    40    43  -0.11250  1.0 3.0
   40    33    38    39   0.15000  1.0 3.0
   40    33    38    42  -0.03700  1.0 1.0
   40    33    38    42   0.37200 -1.0 2.0
   40    33    38    42  -0.47300  1.0 3.0
   40    33   -38    46   0.62750  1.0 1.0
   40    33   -38    46  -0.30950 -1.0 2.0
   40    33   -38    46   0.27300  1.0 3.0
   40    43   -46    38   1.63150  1.0 1.0
   40    43   -46    38   2.92000 -1.0 2.0
   41    40    43    44   0.30150 -1.0 2.0
   41    40    43    46   0.40000  1.0 3.0
   44    43    46    38   3.00000 -1.0 2.0
   46    38    42    45   0.64500  1.0 1.0
   46    38    42    45   0.14800 -1.0 2.0
   46    38    42    45   0.20650  1.0 3.0
   46    38    42    54   0.64500  1.0 1.0
   46    38    42    54   0.14800 -1.0 2.0
   46    38    42    54   0.20650  1.0 3.0
   61    58    59    60   7.00000 -1.0 2.0
   61    58    59    65   7.00000 -1.0 2.0
   49    45    47    48   3.62500 -1.0 2.0
   49    45    47    53   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
   45    54    42    38   4.00000 -1.0 2.0
   47    49    45    42   4.00000 -1.0 2.0
   53    48    47    45   1.10000 -1.0 2.0
   53    55    54    42   4.00000 -1.0 2.0
   55    61    58    59   1.10000 -1.0 2.0
   65    60    59    58   1.10000 -1.0 2.0
   40    46    43    44  10.50000 -1.0 2.0
END
