* LIGAND DATABASE FILE (OPLS2005)
*
001      73    75    131    200     377
    1     0 S   NP   _N1_     1    28.79380    96.35994   -24.33446
    2     1 S   H    _HN1     2     1.02948    72.48174     7.11830
    3     1 S   H    _H1_     3     1.02828    35.69026   172.56439
    4     1 S   H    _H2_     4     1.02792   111.36233   -96.25495
    5     1 S   CT   _CA1     5     1.50122   132.31755   109.08719
    6     5 S   HC   _HA1     6     1.09574   105.17339    93.23065
    7     5 S   CO3  _C1_     7     1.53771   112.42891   -26.98561
    8     7 S   O2Z  _O11     8     1.26374   115.01080   -43.35068
    9     7 S   O2Z  _O12     9     1.26234   114.93723   135.66280
   10     5 S   CT   _CB1    10     1.53060   107.40358  -148.81454
   11    10 S   HC   HB11    11     1.09840   109.33868   -49.51261
   12    10 S   HC   HB12    12     1.09811   110.47301    67.07845
   13    10 S   CT   _CG1    13     1.53017   112.63901  -170.45618
   14    13 S   HC   HG11    14     1.09574   110.70614   -66.75319
   15    13 S   HC   HG12    15     1.09669   109.72911    52.50103
   16    13 S   C    _CD1    16     1.51811   112.02900   172.96441
   17    16 S   O    _OE1    17     1.22754   123.20299    10.75400
   18    16 S   N    _N2_    18     1.38649   111.81458  -169.29656
   19    18 S   H    _HN2    19     1.01587   119.00206     1.19714
   20    18 S   CT1  _CA2    20     1.46220   123.35029   176.87338
   21    20 S   HC   _HA2    21     1.09742   109.27646     6.54164
   22    20 S   C    _C2_    22     1.53661   108.94772  -108.94661
   23    22 S   O    _O2_    23     1.23082   122.20462  -149.71226
   24    20 S   CT   _CB2    32     1.53461   111.63040   128.47337
   25    24 S   HC   HB21    33     1.09478   109.60760    56.75866
   26    24 S   HC   HB22    34     1.09407   109.69331   175.56884
   27    22 S   N    _N3_    24     1.38300   113.87837    37.83001
   28    27 S   H    _HN3    25     1.01551   119.60645    -3.38836
   29    24 S   S    _SG2    35     1.83191   111.08756   -64.28367
   30    27 S   CT   _CA3    26     1.45286   123.28450   177.14001
   31    30 S   HC   HA31    27     1.09547   107.51601   -64.64131
   32    30 S   HC   HA32    28     1.09555   107.99401    51.81785
   33    29 S   CT   _C16    36     1.88069   101.66473  -177.48472
   34    30 S   CO3  _C3_    29     1.52977   114.03339   173.80565
   35    34 S   O2Z  _O31    30     1.26384   116.06378    -0.71162
   36    34 S   O2Z  _O32    31     1.26423   114.42193   179.35441
   37    33 S   CM   _C11    37     1.51956   106.30512   -62.70494
   38    37 S   HC   _H29    38     1.08983   117.74280    84.56381
   39    33 S   CO4  _C15    67     1.54109   108.75130    55.26505
   40    39 S   O    _O20    68     1.22594   124.75530  -128.21160
   41    37 S   CMA  _C13    39     1.34920   124.22668   -95.70214
   42    41 S   OM   _O18    40     1.25920   130.61033   179.81869
   43    39 S   OS   _O24    69     1.36750   110.99327    53.48235
   44    41 S   CM   _C10    41     1.46365   118.03437     2.03509
   45    44 S   HC   _H28    42     1.08777   117.15135   163.80258
   46    43 S   CT   _C20    70     1.43025   115.59256   178.24755
   47    46 S   HC   _H36    71     1.09322   108.06442  -179.77971
   48    46 S   HC   _H37    72     1.09411   110.27626    61.51486
   49    46 S   HC   _H38    73     1.09420   110.25543   -61.17088
   50    44 S   CM   _C14    43     1.35018   122.66368   -16.71104
   51    33 S   CT   _C17    44     1.56800   110.80157   177.21568
   52    50 S   OS   _O23    62     1.38169   126.08125  -178.93559
   53    51 S   CO4  _C12    45     1.52949   112.75673  -158.68343
   54    53 S   O    _O19    46     1.21696   128.76364   -60.89402
   55    52 S   CT   _C19    63     1.42169   117.90011    -0.41401
   56    55 S   HC   _H33    64     1.09408   107.85368  -179.88986
   57    55 S   HC   _H34    65     1.09480   111.00626    62.18163
   58    55 S   HC   _H35    66     1.09480   111.01181   -61.95429
   59    53 S   CA   _C6_    47     1.43914   107.71327   119.16983
   60    59 S   CA   _C8_    48     1.37583   105.84428     0.19077
   61    60 S   CA   _C4_    49     1.38220   120.70441  -179.69481
   62    61 S   HA   _H26    50     1.08551   120.45724  -179.65395
   63    51 S   OS   _O21    61     1.46382   110.37349   -43.04898
   64    61 S   CA   _C7_    51     1.40542   118.49492     0.50706
   65    64 S   CA   _C5_    52     1.41283   119.91411    -1.12640
   66    65 S   HA   _H27    53     1.08772   119.89318  -178.92918
   67    64 S   CT   _C18    57     1.50057   120.08478  -178.52223
   68    67 S   HC   _H30    58     1.09427   109.97011    89.82110
   69    67 S   HC   _H31    59     1.09505   110.86303  -149.66678
   70    67 S   HC   _H32    60     1.09508   110.92697   -30.65727
   71    59 S   CA   _C9_    54     1.37780   131.69067  -179.60833
   72    71 S   OH   _O22    55     1.36041   122.86555    -0.38816
   73    72 S   HO   _H39    56     0.97459   108.39314    -0.18871
  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  11   5   4   3
  17   2   1   1  12   5  11   3   6   3   5   7   3   3   2   1
   1  11   9   6   8   4   3   2   1   1  10   8  10   4   2   8
   8   3   4   2   1   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    51    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    50    51    53    63    39    40    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    44    50    51    53    54    59    60    63    52    39    40    43    46  
   35    36  
   36  
    0  
   38    41    42    44    45    50    51    53    63    39    40    43  
   41    42    44    51    39  
   40    43    46    47    48    49    41    50    51    53    63  
   43    46    51  
   42    44    45    50    51    52  
   44    45    50  
   46    47    48    49    51  
   45    50    51    53    63    52    55  
   50    51    52  
   47    48    49  
   48    49  
   49  
    0  
   51    53    54    59    60    63    52    55    56    57    58  
   53    54    59    60    61    71    63    52    55  
   55    56    57    58    53    63  
   54    59    60    61    65    71    72    63  
   59    60    71    63  
   56    57    58  
   57    58  
   58  
    0  
   60    61    62    64    65    66    71    72    73    63  
   61    62    64    65    71    72    67    63  
   62    64    65    66    71    67    68    69    70    63  
   64    65    67    63  
   64    71  
   65    66    71    72    67    68    69    70  
   66    71    72    73    67    68    69    70  
   71    72    67  
   68    69    70    71  
   69    70  
   70  
    0  
   72    73  
   73  
    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   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   40   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   41   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   44   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   45   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660   0.160000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   48   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   49   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   50   3.5500   0.0760   0.016000   2.0020   1.7750   0.023028004  -0.852763146
   51   3.5000   0.0660   0.317000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   53   3.7500   0.1050   0.537000   2.1120   1.8750   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   55   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   60   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   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   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   64   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   65   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   67   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   72   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   73   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   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    37   317.000  1.510
   33    51   268.000  1.529
   33    39   317.000  1.522
   37    38   340.000  1.080
   37    41   465.000  1.376
   41    42   745.000  1.250
   41    44   465.000  1.376
   44    45   340.000  1.080
   44    50   549.000  1.340
   50    51   317.000  1.510
   50    52   440.000  1.360
   51    53   317.000  1.522
   51    63   320.000  1.410
   53    54   570.000  1.229
   53    59   310.000  1.470
   59    60   469.000  1.400
   59    71   469.000  1.400
   60    61   469.000  1.400
   60    63   450.000  1.364
   61    62   367.000  1.080
   61    64   469.000  1.400
   64    65   469.000  1.400
   64    67   317.000  1.510
   65    66   367.000  1.080
   65    71   469.000  1.400
   71    72   450.000  1.364
   72    73   553.000  0.945
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   52    55   320.000  1.410
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   39    40   570.000  1.229
   39    43   214.000  1.327
   43    46   320.000  1.410
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    49   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    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    37    75.00000  112.20000
   29    33    51    75.00000  111.63000
   29    33    39    75.00000  110.18000
   33    37    38    35.00000  117.00000
   33    37    41    70.00000  124.00000
   33    51    50    70.00000  112.02700
   33    51    53    63.00000  111.10000
   33    51    63    50.00000  109.50000
   33    39    40    80.00000  120.40000
   33    39    43    81.00000  111.40000
   37    41    42    65.00000  137.10300
   37    41    44    70.00000  123.01800
   41    37    38    40.00000  120.50800
   41    44    45    40.00000  120.50800
   41    44    50    70.00000  117.34000
   44    41    42    65.00000  137.10300
   44    50    51    70.00000  124.00000
   44    50    52    80.00000  120.01400
   50    44    45    35.00000  120.00000
   50    51    53    70.00000  109.06800
   50    51    63    85.00000  110.90400
   50    52    55    90.00000  111.18400
   51    33    37    70.00000  112.02700
   51    53    54    80.00000  120.40000
   51    53    59    65.00000  115.47100
   51    63    60    75.00000  111.00000
   53    59    60    60.00000  119.52600
   53    59    71    60.00000  119.52600
   59    53    54    75.00000  123.78400
   59    60    61    63.00000  120.00000
   59    60    63    70.00000  120.00000
   59    71    65    63.00000  120.00000
   59    71    72    70.00000  120.00000
   60    61    62    35.00000  120.00000
   60    61    64    63.00000  120.00000
   61    64    65    63.00000  120.00000
   61    64    67    70.00000  120.00000
   64    61    62    35.00000  120.00000
   64    65    66    35.00000  120.00000
   64    65    71    63.00000  120.00000
   64    67    68    35.00000  109.50000
   64    67    69    35.00000  109.50000
   64    67    70    35.00000  109.50000
   65    71    72    70.00000  120.00000
   71    59    60    63.00000  120.00000
   71    65    66    35.00000  120.00000
   71    72    73    35.00000  113.00000
   67    64    65    70.00000  120.00000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   63    51    53    90.00000  108.74100
   63    60    61    70.00000  120.00000
   52    50    51    85.00000  112.85300
   52    55    56    35.00000  109.50000
   52    55    57    35.00000  109.50000
   52    55    58    35.00000  109.50000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   39    33    37    70.00000  109.06800
   39    33    51    63.00000  111.10000
   39    43    46    83.00000  116.90000
   43    39    40    83.00000  123.40000
   43    46    47    35.00000  109.50000
   43    46    48    35.00000  109.50000
   43    46    49    35.00000  109.50000
   48    46    47    33.00000  107.80000
   49    46    47    33.00000  107.80000
   49    46    48    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -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    34    35   0.00000  1.0 1.0
   27    30    34    36   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    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   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    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    51   0.01700  1.0 1.0
   24    29    33    51  -0.23550 -1.0 2.0
   24    29    33    51   0.21350  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    37    38   0.00000  1.0 1.0
   29    33    37    41   0.42700  1.0 1.0
   29    33    37    41  -0.70350 -1.0 2.0
   29    33    37    41  -0.43150  1.0 3.0
   29    33    51    50   0.56750  1.0 1.0
   29    33    51    50  -0.07550 -1.0 2.0
   29    33    51    50   0.20000  1.0 3.0
   29    33    51    53   0.56750  1.0 1.0
   29    33    51    53  -0.07550 -1.0 2.0
   29    33    51    53   0.20000  1.0 3.0
   29    33    51    63   0.56750  1.0 1.0
   29    33    51    63  -0.07550 -1.0 2.0
   29    33    51    63   0.20000  1.0 3.0
   29    33    39    40   0.30150 -1.0 2.0
   29    33    39    43   0.40000  1.0 3.0
   33    37    41    42   7.00000 -1.0 2.0
   33    37    41    44   7.00000 -1.0 2.0
   33    51    53    54   0.30150 -1.0 2.0
   33    51    53    59   0.05850 -1.0 2.0
   33    51    53    59   0.17250  1.0 3.0
   33    51    63    60  -0.32850  1.0 1.0
   33    51    63    60  -0.35800 -1.0 2.0
   33    51    63    60   0.33950  1.0 3.0
   33    39    43    46   1.63150  1.0 1.0
   33    39    43    46   2.92000 -1.0 2.0
   37    33    51    50   0.31000  1.0 1.0
   37    33    51    50   0.14700 -1.0 2.0
   37    33    51    50   0.07550  1.0 3.0
   37    33    51    53  -0.98800  1.0 1.0
   37    33    51    53   0.48800 -1.0 2.0
   37    33    51    53   0.76800  1.0 3.0
   37    33    51    63   0.61850  1.0 1.0
   37    33    51    63  -0.22750 -1.0 2.0
   37    33    51    63   0.15300  1.0 3.0
   37    33    39    40   0.30150 -1.0 2.0
   37    33    39    43   0.40000  1.0 3.0
   37    41    44    45   7.00000 -1.0 2.0
   37    41   -44    50   7.00000 -1.0 2.0
   38    37    41    42   7.00000 -1.0 2.0
   38    37    41    44   7.00000 -1.0 2.0
   41    44    50    51   7.00000 -1.0 2.0
   41    44    50    52   7.00000 -1.0 2.0
   42    41    44    45   7.00000 -1.0 2.0
   42    41    44    50   7.00000 -1.0 2.0
   44    50   -51    33   0.09850  1.0 1.0
   44    50   -51    33   0.15250 -1.0 2.0
   44    50   -51    33  -0.50650  1.0 3.0
   44    50    51    53  -0.51250  1.0 1.0
   44    50    51    53  -0.88800 -1.0 2.0
   44    50    51    53   0.08850  1.0 3.0
   44    50    51    63   0.39000  1.0 1.0
   44    50    51    63  -0.05800 -1.0 2.0
   44    50    51    63  -0.55150  1.0 3.0
   44    50    52    55  -2.26850  1.0 1.0
   44    50    52    55   3.39050 -1.0 2.0
   45    44    50    51   7.00000 -1.0 2.0
   45    44    50    52   7.00000 -1.0 2.0
   50    51    53    54   0.30150 -1.0 2.0
   50    51    53    59   0.65300  1.0 1.0
   50    51    53    59  -0.03850 -1.0 2.0
   50    51    53    59   0.33900  1.0 3.0
   50    51    63    60  -0.25600  1.0 1.0
   50    51    63    60  -0.40050 -1.0 2.0
   50    51    63    60   0.34700  1.0 3.0
   50    52    55    56   0.08050  1.0 3.0
   50    52    55    57   0.08050  1.0 3.0
   50    52    55    58   0.08050  1.0 3.0
   51    33    37    38   0.00000  1.0 1.0
   51    33   -37    41   0.09850  1.0 1.0
   51    33   -37    41   0.15250 -1.0 2.0
   51    33   -37    41  -0.50650  1.0 3.0
   51    33    39    40   0.30150 -1.0 2.0
   51    33    39    43   0.36750  1.0 3.0
   51    50    52    55   2.00000 -1.0 2.0
   51    53   -59    60   2.26350  1.0 1.0
   51    53   -59    60   0.76750 -1.0 2.0
   51    53   -59    60   0.22500  1.0 3.0
   51    53    59    71   2.26350  1.0 1.0
   51    53    59    71   0.76750 -1.0 2.0
   51    53    59    71   0.22500  1.0 3.0
   53    51   -63    60  -0.25600  1.0 1.0
   53    51   -63    60  -0.40050 -1.0 2.0
   53    51   -63    60   0.34700  1.0 3.0
   53    59    60    61   3.62500 -1.0 2.0
   53    59   -60    63   3.62500 -1.0 2.0
   53    59    71    65   3.62500 -1.0 2.0
   53    59    71    72   3.62500 -1.0 2.0
   54    53    59    60   1.05000 -1.0 2.0
   54    53    59    71   1.05000 -1.0 2.0
   59    60    61    62   3.62500 -1.0 2.0
   59    60    61    64   3.62500 -1.0 2.0
   59    60   -63    51   1.63200 -1.0 2.0
   59    71    72    73   0.84100 -1.0 2.0
   60    59    71    65   3.62500 -1.0 2.0
   60    59    71    72   3.62500 -1.0 2.0
   60    61   -64    65   3.62500 -1.0 2.0
   60    61    64    67   3.62500 -1.0 2.0
   61    60    63    51   1.63200 -1.0 2.0
   61    64    65    66   3.62500 -1.0 2.0
   61    64    65    71   3.62500 -1.0 2.0
   61    64    67    68   0.00000  1.0 1.0
   61    64    67    69   0.00000  1.0 1.0
   61    64    67    70   0.00000  1.0 1.0
   62    61    64    65   3.62500 -1.0 2.0
   62    61    64    67   3.62500 -1.0 2.0
   64    65   -71    59   3.62500 -1.0 2.0
   64    65    71    72   3.62500 -1.0 2.0
   65    64    67    68   0.00000  1.0 1.0
   65    64    67    69   0.00000  1.0 1.0
   65    64    67    70   0.00000  1.0 1.0
   65    71    72    73   0.84100 -1.0 2.0
   66    65    71    59   3.62500 -1.0 2.0
   66    65    71    72   3.62500 -1.0 2.0
   71    59   -60    61   3.62500 -1.0 2.0
   71    59    60    63   3.62500 -1.0 2.0
   67    64    65    66   3.62500 -1.0 2.0
   67    64    65    71   3.62500 -1.0 2.0
   63    51    53    54   0.30150 -1.0 2.0
   63    51   -53    59   0.65300  1.0 1.0
   63    51   -53    59  -0.03850 -1.0 2.0
   63    51   -53    59   0.33900  1.0 3.0
   63    60    61    62   3.62500 -1.0 2.0
   63    60    61    64   3.62500 -1.0 2.0
   52    50    51    33   0.09700  1.0 1.0
   52    50    51    33   0.15600 -1.0 2.0
   52    50    51    33  -0.50800  1.0 3.0
   52    50    51    53   0.09700  1.0 1.0
   52    50    51    53   0.15600 -1.0 2.0
   52    50    51    53  -0.50800  1.0 3.0
   52    50    51    63   0.09700  1.0 1.0
   52    50    51    63   0.15600 -1.0 2.0
   52    50    51    63  -0.50800  1.0 3.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    41  -0.51250  1.0 1.0
   39    33    37    41  -0.88800 -1.0 2.0
   39    33    37    41   0.08850  1.0 3.0
   39    33    51    50  -0.98800  1.0 1.0
   39    33    51    50   0.48800 -1.0 2.0
   39    33    51    50   0.76800  1.0 3.0
   39    33    51    53   0.11950  1.0 1.0
   39    33    51    53   0.20300 -1.0 2.0
   39    33    51    53  -0.70800  1.0 3.0
   39    33    51    63  -0.09450  1.0 1.0
   39    33    51    63  -1.12950 -1.0 2.0
   39    33    51    63   0.54000  1.0 3.0
   39    43    46    47   0.08050  1.0 3.0
   39    43    46    48   0.08050  1.0 3.0
   39    43    46    49   0.08050  1.0 3.0
   40    39    43    46   3.00000 -1.0 2.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    34    35  10.50000 -1.0 2.0
   33    38    37    41   1.10000 -1.0 2.0
   44    42    41    37   1.10000 -1.0 2.0
   41    45    44    50   1.10000 -1.0 2.0
   51    52    50    44   1.10000 -1.0 2.0
   51    59    53    54  10.50000 -1.0 2.0
   60    71    59    53   4.00000 -1.0 2.0
   61    63    60    59   4.00000 -1.0 2.0
   64    62    61    60   1.10000 -1.0 2.0
   65    67    64    61   4.00000 -1.0 2.0
   71    66    65    64   1.10000 -1.0 2.0
   65    72    71    59   4.00000 -1.0 2.0
   33    43    39    40  10.50000 -1.0 2.0
END
