* LIGAND DATABASE FILE (OPLS2005)
*
001      67    68    115    181     339
    1     0 S   NP   _N1_     1    28.75048    95.69402   -22.55153
    2     1 S   H    _HN1     2     1.02958    78.98309    17.84608
    3     1 S   H    _H1_     3     1.02837    34.06571   163.06817
    4     1 S   H    _H2_     4     1.02780    99.60104   -89.11976
    5     1 S   CT   _CA1     5     1.50121   140.62141   126.66811
    6     5 S   HC   _HA1     6     1.09577   105.21881    80.01260
    7     5 S   CO3  _C1_     7     1.53765   112.35983   -40.17515
    8     7 S   O2Z  _O11     8     1.26358   115.00492   -44.71586
    9     7 S   O2Z  _O12     9     1.26233   114.90660   134.38418
   10     5 S   CT   _CB1    10     1.53083   107.42011  -162.11844
   11    10 S   HC   HB11    11     1.09829   109.27393   -50.93286
   12    10 S   HC   HB12    12     1.09817   110.44473    65.58980
   13    10 S   CT   _CG1    13     1.53032   112.71411  -172.02469
   14    13 S   HC   HG11    14     1.09594   110.49623   -64.89625
   15    13 S   HC   HG12    15     1.09658   109.93686    54.34719
   16    13 S   C    _CD1    16     1.51832   112.24619   174.66311
   17    16 S   O    _OE1    17     1.22733   123.21944     0.55320
   18    16 S   N    _N2_    18     1.38632   111.70658  -179.22116
   19    18 S   H    _HN2    19     1.01594   119.09915     0.97116
   20    18 S   CT1  _CA2    20     1.46188   123.35457   179.04060
   21    20 S   HC   _HA2    21     1.09730   109.32800    -1.68586
   22    20 S   C    _C2_    22     1.53579   109.13210  -117.34038
   23    22 S   O    _O2_    23     1.23061   122.04473  -151.00307
   24    20 S   CT   _CB2    32     1.53340   111.41415   120.20697
   25    24 S   HC   HB21    33     1.09514   109.74384    56.20987
   26    24 S   HC   HB22    34     1.09440   110.11084   175.27864
   27    22 S   N    _N3_    24     1.38425   113.86253    36.59996
   28    27 S   H    _HN3    25     1.01476   119.00867    -0.55355
   29    24 S   S    _SG2    35     1.82801   111.81011   -65.36582
   30    27 S   CT   _CA3    26     1.45428   123.30725   175.33629
   31    30 S   HC   HA31    27     1.09534   109.17503    26.93381
   32    30 S   HC   HA32    28     1.09497   107.17945   143.88536
   33    29 S   CT   _C10    36     1.84418    99.55969   175.69220
   34    33 S   HC   _H3_    37     1.09251   105.08276    45.65298
   35    30 S   CO3  _C3_    29     1.52888   112.97128   -96.49420
   36    35 S   O2Z  _O31    30     1.26410   115.28929   -48.67048
   37    35 S   O2Z  _O32    31     1.26343   115.05589   132.20328
   38    33 S   CA   _C9_    38     1.52081   110.55306   161.88295
   39    33 S   CM   _C11    50     1.51063   109.72107   -73.61576
   40    39 S   HC   _H8_    51     1.09260   114.92085   -49.51552
   41    38 S   CA   _C4_    39     1.40530   119.53029  -114.28358
   42    41 S   HA   _H4_    40     1.08753   120.40973     0.00000
   43    39 S   CMA  _C12    52     1.35435   128.77244   129.73963
   44    43 S   OM   _O36    53     1.26400   128.06831   179.88131
   45    41 S   CA   _C5_    41     1.39605   120.81135  -179.92598
   46    45 S   HA   _H5_    42     1.08619   119.83868   179.98022
   47    43 S   CT   _C13    54     1.53456   120.65720     2.52228
   48    47 S   HC   _H9_    55     1.09887   109.34337    38.66084
   49    47 S   HC   _H10    56     1.10109   111.33821   152.65307
   50    45 S   CA   _C6_    43     1.39070   119.64785     0.00000
   51    47 S   CM   _C14    57     1.51027   113.78551   -85.05498
   52    50 S   CA   _C7_    44     1.39173   120.70877     0.00000
   53    52 S   HA   _H6_    45     1.08596   121.02937   180.00000
   54    50 S   OH   _O37    48     1.36619   118.21434  -180.00000
   55    54 S   HO   _H14    49     0.97237   108.51766  -179.84934
   56    51 S   CM   _C15    58     1.33978   123.86078   122.46803
   57    56 S   HC   _H11    59     1.08427   121.73394    -0.39366
   58    38 S   CA   _C8_    46     1.40637   122.02579    65.83091
   59    58 S   HA   _H7_    47     1.08755   120.47446    -0.14265
   60    56 S   CM   _C16    60     1.43275   119.27576  -179.34210
   61    60 S   CM   _C17    61     1.33691   121.21894    -0.75017
   62    61 S   HC   _H12    62     1.08329   122.38864   179.37693
   63    60 S   OH   _O35    66     1.37414   115.07283   178.48535
   64    63 S   HO   _H13    67     0.97292   108.10550  -176.84737
   65    61 S   CO4  _C18    63     1.47561   120.06539    -0.22900
   66    65 S   O    _O33    64     1.22674   120.51178  -179.56795
   67    51 S   OS   _O34    65     1.41986   115.17547   -58.55924
  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   8   5   4   3
  13   6   2   1   1  12   9   3   8   4   7   4   7   3   8   4
   3   6   8   5   3   2   1   8   4   1   1   7   6   4   2   1
   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    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    58    39    40    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    45    52    58    59    39    40    43    44    47  
   38    41    58    39    40    43  
   36    37  
   37  
    0  
   41    42    45    46    50    52    53    58    59    39    40    43  
   40    43    44    47    48    49    51    41    58  
   43    44    47  
   42    45    46    50    52    58    59    54  
   45    46    50    58  
   44    47    48    49    51    56    67  
   47    48    49    51  
   46    50    52    53    58    54    55  
   50    52    54  
   48    49    51    56    57    60    65    67  
   49    51    56    67  
   51    56    67  
   52    53    58    59    54    55  
   56    57    60    61    65    66    67    63  
   53    58    59    54    55  
   58    59    54  
   55    58  
    0  
   57    60    61    62    65    67    63    64  
   60    61    67    63  
   59  
    0  
   61    62    65    66    67    63    64  
   62    65    66    67    63    64  
   65    66    67    63  
   64    65  
    0  
   66    67  
   67  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.222500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   40   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   43   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   44   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   51   3.5500   0.0760   0.085000   2.0020   1.7750   0.023028004  -0.852763146
   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   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   55   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   56   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   57   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   59   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   60   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   61   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   62   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   63   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   64   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   65   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   66   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   67   2.8500   0.1400  -0.165000   1.5900   1.4000   0.020110767  -0.896042159
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    39   317.000  1.510
   38    41   469.000  1.400
   38    58   469.000  1.400
   41    42   367.000  1.080
   41    45   469.000  1.400
   45    46   367.000  1.080
   45    50   469.000  1.400
   50    52   469.000  1.400
   50    54   450.000  1.364
   52    53   367.000  1.080
   52    58   469.000  1.400
   58    59   367.000  1.080
   54    55   553.000  0.945
   39    40   340.000  1.080
   39    43   465.000  1.376
   43    44   745.000  1.250
   43    47   270.000  1.512
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    51   317.000  1.510
   51    56   549.000  1.340
   51    67   440.000  1.360
   56    57   340.000  1.080
   56    60   380.000  1.444
   60    61   549.000  1.340
   60    63   510.000  1.338
   61    62   340.000  1.080
   61    65   320.000  1.462
   65    66   570.000  1.229
   65    67   214.000  1.327
   63    64   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    80.00000  109.48900
   29    33    39    75.00000  112.20000
   33    38    41    70.00000  120.00000
   33    38    58    70.00000  120.00000
   33    39    40    35.00000  117.00000
   33    39    43    70.00000  124.00000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    45    63.00000  120.00000
   38    58    52    63.00000  120.00000
   38    58    59    35.00000  120.00000
   41    45    46    35.00000  120.00000
   41    45    50    63.00000  120.00000
   45    41    42    35.00000  120.00000
   45    50    52    63.00000  120.00000
   45    50    54    70.00000  120.00000
   50    45    46    35.00000  120.00000
   50    52    53    35.00000  120.00000
   50    52    58    63.00000  120.00000
   50    54    55    35.00000  113.00000
   52    58    59    35.00000  120.00000
   58    38    41    63.00000  120.00000
   58    52    53    35.00000  120.00000
   54    50    52    70.00000  120.00000
   39    33    34    35.00000  109.50000
   39    33    38    70.00000  112.99600
   39    43    44    65.00000  137.10300
   39    43    47    65.00000  122.18000
   43    39    40    40.00000  120.50800
   43    47    48    45.00000  110.52000
   43    47    49    45.00000  110.52000
   43    47    51    70.00000  110.12100
   47    43    44    85.00000  112.85300
   47    51    56    70.00000  124.00000
   47    51    67    85.00000  112.85300
   49    47    48    33.00000  107.80000
   51    47    48    35.00000  109.50000
   51    47    49    35.00000  109.50000
   51    56    57    35.00000  120.00000
   51    56    60    70.00000  123.01800
   51    67    65    90.00000  114.22900
   56    60    61    70.00000  123.01800
   56    60    63    80.00000  121.38400
   60    56    57    35.00000  120.00000
   60    61    62    35.00000  120.00000
   60    61    65    65.00000  118.96000
   60    63    64    70.00000  107.45700
   61    65    66    80.00000  123.72100
   61    65    67    90.00000  111.29400
   65    61    62    40.00000  117.72500
   67    51    56    80.00000  120.01400
   67    65    66    83.00000  123.40000
   63    60    61    80.00000  121.38400
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    39  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    38    58  -0.16000  1.0 1.0
   29    33    38    58  -0.03200 -1.0 2.0
   29    33    38    58   0.04500  1.0 3.0
   29    33    39    40   0.00000  1.0 1.0
   29    33    39    43   0.42700  1.0 1.0
   29    33    39    43  -0.70350 -1.0 2.0
   29    33    39    43  -0.43150  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    45   3.62500 -1.0 2.0
   33    38    58    52   3.62500 -1.0 2.0
   33    38    58    59   3.62500 -1.0 2.0
   33    39    43    44   7.00000 -1.0 2.0
   33    39    43    47   7.00000 -1.0 2.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    58   0.00000  1.0 1.0
   34    33    39    40   0.33100  1.0 3.0
   34    33    39    43   0.00000  1.0 1.0
   38    33    39    40   0.00000  1.0 1.0
   38    33    39    43   1.44450  1.0 1.0
   38    33    39    43   0.06600 -1.0 2.0
   38    33    39    43   0.29250  1.0 3.0
   38    41    45    46   3.62500 -1.0 2.0
   38    41    45    50   3.62500 -1.0 2.0
   41    38    58    52   3.62500 -1.0 2.0
   41    38    58    59   3.62500 -1.0 2.0
   41    45   -50    52   3.62500 -1.0 2.0
   41    45    50    54   3.62500 -1.0 2.0
   42    41    45    46   3.62500 -1.0 2.0
   42    41    45    50   3.62500 -1.0 2.0
   45    50    52    53   3.62500 -1.0 2.0
   45    50    52    58   3.62500 -1.0 2.0
   45    50    54    55   0.84100 -1.0 2.0
   46    45    50    52   3.62500 -1.0 2.0
   46    45    50    54   3.62500 -1.0 2.0
   50    52   -58    38   3.62500 -1.0 2.0
   50    52    58    59   3.62500 -1.0 2.0
   52    50    54    55   0.84100 -1.0 2.0
   53    52    58    38   3.62500 -1.0 2.0
   53    52    58    59   3.62500 -1.0 2.0
   58    38    41    42   3.62500 -1.0 2.0
   58    38   -41    45   3.62500 -1.0 2.0
   54    50    52    53   3.62500 -1.0 2.0
   54    50    52    58   3.62500 -1.0 2.0
   39    33    38    41   0.18050 -1.0 2.0
   39    33    38    58   0.18050 -1.0 2.0
   39    43    47    48   0.00000  1.0 1.0
   39    43    47    49   0.00000  1.0 1.0
   39    43    47    51  -0.28300  1.0 1.0
   39    43    47    51   0.26700 -1.0 2.0
   39    43    47    51  -0.63300  1.0 3.0
   40    39    43    44   7.00000 -1.0 2.0
   40    39    43    47   7.00000 -1.0 2.0
   43    47    51    56  -0.28300  1.0 1.0
   43    47    51    56   0.26700 -1.0 2.0
   43    47    51    56  -0.63300  1.0 3.0
   43    47    51    67   0.09700  1.0 1.0
   43    47    51    67   0.15600 -1.0 2.0
   43    47    51    67  -0.50800  1.0 3.0
   44    43    47    48   0.00000  1.0 1.0
   44    43    47    49   0.00000  1.0 1.0
   44    43    47    51   0.09700  1.0 1.0
   44    43    47    51   0.15600 -1.0 2.0
   44    43    47    51  -0.50800  1.0 3.0
   47    51    56    57   7.00000 -1.0 2.0
   47    51    56    60   7.00000 -1.0 2.0
   47    51    67    65   2.00000 -1.0 2.0
   48    47    51    56   0.00000  1.0 1.0
   48    47    51    67   0.00000  1.0 1.0
   49    47    51    56   0.00000  1.0 1.0
   49    47    51    67   0.00000  1.0 1.0
   51    56    60    61   0.28850  1.0 1.0
   51    56    60    61   2.61350 -1.0 2.0
   51    56    60    61   0.78400  1.0 3.0
   51    56    60    63   0.50950  1.0 1.0
   51    56    60    63   0.56650 -1.0 2.0
   51    56    60    63   0.34050  1.0 3.0
   56    51    67    65  -1.93650  1.0 1.0
   56    51    67    65   2.17750 -1.0 2.0
   56    51    67    65  -0.40250  1.0 3.0
   56    60    61    62   7.00000 -1.0 2.0
   56    60   -61    65   7.00000 -1.0 2.0
   56    60    63    64  -0.66100  1.0 1.0
   56    60    63    64   1.20850 -1.0 2.0
   56    60    63    64  -0.36000  1.0 3.0
   57    56    60    61  -0.18600  1.0 3.0
   57    56    60    63   0.00000  1.0 1.0
   60    61    65    66   1.00000 -1.0 2.0
   60    61    65    67  -0.56150  1.0 1.0
   60    61    65    67   2.19150 -1.0 2.0
   61    60    63    64  -0.66100  1.0 1.0
   61    60    63    64   1.20850 -1.0 2.0
   61    60    63    64  -0.36000  1.0 3.0
   61    65   -67    51   2.00000 -1.0 2.0
   62    61    65    66   0.00000  1.0 1.0
   62    61    65    67   1.63100 -1.0 2.0
   66    65    67    51   3.00000 -1.0 2.0
   67    51    56    57   7.00000 -1.0 2.0
   67    51   -56    60   7.00000 -1.0 2.0
   63    60    61    62   7.00000 -1.0 2.0
   63    60    61    65   7.00000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   41    58    38    33   4.00000 -1.0 2.0
   45    42    41    38   1.10000 -1.0 2.0
   50    46    45    41   1.10000 -1.0 2.0
   52    54    50    45   4.00000 -1.0 2.0
   58    53    52    50   1.10000 -1.0 2.0
   52    59    58    38   1.10000 -1.0 2.0
   33    40    39    43  15.00000 -1.0 2.0
   47    44    43    39  15.00000 -1.0 2.0
   47    67    51    56   1.10000 -1.0 2.0
   60    57    56    51   1.10000 -1.0 2.0
   56    63    60    61   1.10000 -1.0 2.0
   65    62    61    60   1.10000 -1.0 2.0
   61    67    65    66  10.50000 -1.0 2.0
END
