* LIGAND DATABASE FILE (OPLS2005)
*
001      76    79    147    234     435
    1     0 S   NP   _N1_     1    28.84688    95.96925   -21.15693
    2     1 S   H    _HN1     2     1.02952    83.92891    26.30741
    3     1 S   H    _H1_     3     1.02844    39.22004   153.06753
    4     1 S   H    _H2_     4     1.02798    86.19187   -82.50663
    5     1 S   CT   _CA1     5     1.50017   149.93634   147.79193
    6     5 S   HC   _HA1     6     1.09562   105.36854    62.88535
    7     5 S   CO3  _C1_     7     1.53796   112.39355   -57.72795
    8     7 S   O2Z  _O11     8     1.26372   115.14608   -47.73455
    9     7 S   O2Z  _O12     9     1.26245   115.04313   132.05234
   10     5 S   CT   _CB1    10     1.53116   107.52002  -178.95320
   11    10 S   HC   HB11    11     1.09818   109.70468   -49.66291
   12    10 S   HC   HB12    12     1.09826   110.29496    66.98330
   13    10 S   CT   _CG1    13     1.52983   112.46104  -170.66321
   14    13 S   HC   HG11    14     1.09598   110.50464   -57.68737
   15    13 S   HC   HG12    15     1.09634   110.03830    61.51589
   16    13 S   C    _CD1    16     1.51728   112.27004  -177.81573
   17    16 S   O    _OE1    17     1.22701   123.31022    -4.32418
   18    16 S   N    _N2_    18     1.38578   111.50092   175.23794
   19    18 S   H    _HN2    19     1.01586   119.03220     3.44162
   20    18 S   CT1  _CA2    20     1.46269   123.45260  -176.97923
   21    20 S   HC   _HA2    21     1.09724   109.42335   -10.92690
   22    20 S   C    _C2_    22     1.53339   108.39721  -126.70357
   23    22 S   O    _O2_    23     1.23011   122.43218  -147.60511
   24    20 S   CT   _CB2    32     1.53397   111.01019   111.06034
   25    24 S   HC   HB21    33     1.09582   109.51237    55.53724
   26    24 S   HC   HB22    34     1.09493   110.72788   174.44385
   27    22 S   N    _N3_    24     1.38381   113.41422    39.82527
   28    27 S   H    _HN3    25     1.01646   119.49748    -3.44384
   29    24 S   S    _SG2    35     1.83035   111.28706   -65.77318
   30    27 S   CT   _CA3    26     1.45294   123.11169   176.99469
   31    30 S   HC   HA31    27     1.09552   107.50143   -64.29721
   32    30 S   HC   HA32    28     1.09558   107.97376    52.11264
   33    29 S   CT   _C18    36     1.85396   100.03512   153.42114
   34    33 S   HC   _H5_    37     1.09269   105.83286   -45.39070
   35    30 S   CO3  _C3_    29     1.52932   114.13649   174.09598
   36    35 S   O2Z  _O31    30     1.26364   116.04562    -1.45683
   37    35 S   O2Z  _O32    31     1.26428   114.41731   178.61549
   38    33 S   CM   _C17    38     1.50645   107.37921    69.15525
   39    38 S   HC   _H17    39     1.08818   117.34564   -93.83824
   40    38 S   CMA  _C16    40     1.34659   123.00039    85.33289
   41    40 S   OM   _O34    41     1.25954   130.84518  -178.95395
   42    40 S   CT   _C15    42     1.52267   116.09246     0.14935
   43    42 S   HC   _H15    43     1.10058   111.41967   163.68436
   44    42 S   HC   _H16    44     1.09849   108.70697   -79.60883
   45    42 S   CT   _C14    45     1.54060   112.76792    42.09217
   46    45 S   HC   _H4_    46     1.09789   107.63288  -166.91547
   47    33 S   CT   _C7_    47     1.56873   114.19654  -164.97732
   48    45 S   OS   _O33    56     1.45306   105.87007    80.38334
   49    47 S   CR3  _C8_    48     1.50867   111.88833   163.79004
   50    47 S   CT   _C6_    70     1.55525   115.30861    40.31450
   51    50 S   HC   _H11    71     1.09798   108.56410   -70.59090
   52    50 S   HC   _H12    72     1.09994   109.83586   175.34785
   53    49 S   CA   _C9_    49     1.39107   129.30595   -68.67032
   54    53 S   CA   _C10    50     1.40496   117.83125   179.09453
   55    54 S   HA   _H13    51     1.08837   120.26889  -179.15142
   56    53 S   CT   _C20    62     1.49953   122.15481    -4.81678
   57    56 S   HC   _H21    63     1.09381   112.69766    65.62145
   58    56 S   HC   _H22    64     1.09662   109.24809  -175.79593
   59    54 S   CA   _C11    52     1.40362   121.40988     2.43148
   60    59 S   HA   _H14    53     1.08569   117.80591   179.50386
   61    56 S   NP   _N4_    65     1.51804   112.99431   -57.58686
   62    61 S   H    _H3_    66     1.02917   107.43124   -39.79087
   63    59 S   CA   _C12    54     1.39351   120.28581     1.32175
   64    61 S   CT   _C5_    67     1.51216   114.13638    79.38638
   65    64 S   HC   _H9_    68     1.09622   106.34453   171.12684
   66    64 S   HC   _H10    69     1.09277   107.44807    55.74735
   67    61 S   CT   _C4_    73     1.51015   110.99367  -154.88962
   68    67 S   HC   _H6_    74     1.09300   108.45758   -64.80302
   69    67 S   HC   _H7_    75     1.09326   108.22384    55.95538
   70    67 S   HC   _H8_    76     1.09221   107.98542   174.14482
   71    49 S   CA   _C13    55     1.38703   110.68411   115.54543
   72    63 S   OS   _O35    57     1.36591   126.08195   177.47640
   73    72 S   CT   _C19    58     1.42226   116.85102     1.99743
   74    73 S   HC   _H18    59     1.09428   107.76699   179.02582
   75    73 S   HC   _H19    60     1.09506   111.17085    61.22764
   76    73 S   HC   _H20    61     1.09499   111.10312   -63.22174
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  17   7   2   1   1  10   4   8   4   9   5   4  11   5  14   7
  15  11   5   4  13  10   4  13   5   4   5   3   8   7   6   6
   2   1   3   2   1   1   2   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    47    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    45    47    49    50  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    45    46    47    49    53    71    48    64    50    51    52  
   38    39    40    45    47    49    50  
   36    37  
   37  
    0  
   39    40    41    42    43    44    45    47    49    50  
   40    41    42    47  
   41    42    43    44    45    46    47    48  
   42    43    44    45  
   43    44    45    46    47    49    71    48    50  
   44    45    46    47    48  
   45    46    47    48  
   46    47    49    53    63    71    48    64    50    51    52  
   47    49    71    48    50  
   49    53    54    63    71    48    56    61    64    65    66    50    51    52  
   72    50    49    53    59    63    71  
   53    54    55    59    63    71    72    56    57    58    61    64    50    51    52  
   51    52    67    53    56    61    62    64    65    66    71  
   52    61    64    65    66  
   61    64    65    66  
   54    55    59    60    63    71    56    57    58    61    62    64    67  
   55    59    60    63    71    72    56    57    58    61  
   59    60    63    56  
   57    58    61    62    64    65    66    67    68    69    70    59    71  
   58    61    62    64    67  
   61    62    64    67  
   60    63    71    72    73  
   63    71    72  
   62    64    65    66    67    68    69    70  
   64    65    66    67    68    69    70  
   71    72    73    74    75    76  
   65    66    67    68    69    70  
   66    67  
   67  
   68    69    70  
   69    70  
   70  
    0  
   72    73  
   73    74    75    76  
   74    75    76  
   75    76  
   76  
    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   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660   0.115000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   49   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   50   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   53   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   54   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   55   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   56   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   59   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   60   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   61   3.2500   0.1700  -0.100000   2.1950   1.9500   0.003973653   1.685851020
   62   0.5000   0.0300   0.290000   0.9960   0.8600   0.030040813  -0.651083722
   63   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   64   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   67   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   71   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   72   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   73   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   75   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   76   2.5000   0.0300   0.030000   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   317.000  1.510
   33    47   268.000  1.529
   38    39   340.000  1.080
   38    40   465.000  1.376
   40    41   745.000  1.250
   40    42   270.000  1.512
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   268.000  1.529
   45    46   340.000  1.090
   45    47   268.000  1.529
   45    48   320.000  1.410
   47    49   317.000  1.510
   47    50   268.000  1.529
   49    53   490.000  1.398
   49    71   490.000  1.398
   53    54   469.000  1.400
   53    56   317.000  1.510
   54    55   367.000  1.080
   54    59   469.000  1.400
   59    60   367.000  1.080
   59    63   469.000  1.400
   63    71   469.000  1.400
   63    72   450.000  1.364
   71    48   450.000  1.364
   72    73   320.000  1.410
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    76   340.000  1.090
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    61   367.000  1.471
   61    62   434.000  1.010
   61    64   367.000  1.471
   61    67   367.000  1.471
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    50   268.000  1.529
   50    51   340.000  1.090
   50    52   340.000  1.090
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   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  112.20000
   29    33    47    75.00000  111.63000
   33    38    39    35.00000  117.00000
   33    38    40    70.00000  124.00000
   33    47    45    58.35000  112.70000
   33    47    49    70.00000  112.17500
   33    47    50    58.35000  112.70000
   38    33    34    35.00000  109.50000
   38    40    41    65.00000  137.10300
   38    40    42    65.00000  122.18000
   40    38    39    40.00000  120.50800
   40    42    43    45.00000  110.52000
   40    42    44    45.00000  110.52000
   40    42    45    70.00000  112.02700
   42    40    41    85.00000  112.85300
   42    45    46    37.50000  110.70000
   42    45    47    58.35000  112.70000
   42    45    48    50.00000  109.50000
   44    42    43    33.00000  107.80000
   45    42    43    37.50000  110.70000
   45    42    44    37.50000  110.70000
   45    47    49    70.00000  112.17500
   45    47    50    58.35000  112.70000
   45    48    71    75.00000  111.00000
   47    33    34    37.50000  110.70000
   47    33    38    70.00000  112.02700
   47    45    46    37.50000  110.70000
   47    49    53    70.00000  120.00000
   47    49    71    70.00000  120.00000
   47    50    64    58.35000  112.70000
   47    50    51    37.50000  110.70000
   47    50    52    37.50000  110.70000
   49    53    54    70.00000  112.88000
   49    53    56    80.00000  105.07000
   49    71    63    70.00000  112.88000
   49    71    48    70.00000  120.00000
   53    54    55    35.00000  120.00000
   53    54    59    63.00000  120.00000
   53    56    57    35.00000  109.50000
   53    56    58    35.00000  109.50000
   53    56    61    75.00000  110.83300
   54    59    60    35.00000  120.00000
   54    59    63    63.00000  120.00000
   59    54    55    35.00000  120.00000
   59    63    71    63.00000  120.00000
   59    63    72    70.00000  120.00000
   63    59    60    35.00000  120.00000
   63    71    48    70.00000  120.00000
   63    72    73    75.00000  111.00000
   71    49    53    60.00000  130.80000
   48    45    46    35.00000  109.50000
   48    45    47    50.00000  109.50000
   72    63    71    70.00000  120.00000
   72    73    74    35.00000  109.50000
   72    73    75    35.00000  109.50000
   72    73    76    35.00000  109.50000
   75    73    74    33.00000  107.80000
   76    73    74    33.00000  107.80000
   76    73    75    33.00000  107.80000
   56    53    54    70.00000  120.00000
   56    61    62    35.00000  109.50000
   56    61    64    75.00000  113.01200
   56    61    67    75.00000  113.01200
   58    56    57    33.00000  107.80000
   61    56    57    35.00000  109.50000
   61    56    58    35.00000  109.50000
   61    64    65    35.00000  109.50000
   61    64    66    35.00000  109.50000
   61    64    50    80.00000  111.20000
   61    67    68    35.00000  109.50000
   61    67    69    35.00000  109.50000
   61    67    70    35.00000  109.50000
   64    61    62    35.00000  109.50000
   64    50    51    37.50000  110.70000
   64    50    52    37.50000  110.70000
   66    64    65    33.00000  107.80000
   50    47    49    70.00000  112.17500
   50    64    65    37.50000  110.70000
   50    64    66    37.50000  110.70000
   52    50    51    33.00000  107.80000
   67    61    62    35.00000  109.50000
   67    61    64    75.00000  113.01200
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    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  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    47   0.01700  1.0 1.0
   24    29    33    47  -0.23550 -1.0 2.0
   24    29    33    47   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   0.00000  1.0 1.0
   29    33    38    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    47    45   0.44750  1.0 1.0
   29    33    47    45  -0.17800 -1.0 2.0
   29    33    47    45   0.20200  1.0 3.0
   29    33    47    49   0.56750  1.0 1.0
   29    33    47    49  -0.07550 -1.0 2.0
   29    33    47    49   0.20000  1.0 3.0
   29    33    47    50   0.44750  1.0 1.0
   29    33    47    50  -0.17800 -1.0 2.0
   29    33    47    50   0.20200  1.0 3.0
   33    38    40    41   7.00000 -1.0 2.0
   33    38    40    42   7.00000 -1.0 2.0
   33    47    49    53   0.04150 -1.0 2.0
   33    47    49    71   0.04150 -1.0 2.0
   33    47    50    64   0.56750  1.0 1.0
   33    47    50    64  -0.07550 -1.0 2.0
   33    47    50    64   0.20000  1.0 3.0
   33    47    50    51   0.15000  1.0 3.0
   33    47    50    52   0.15000  1.0 3.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    47    45   0.15000  1.0 3.0
   34    33    47    49   0.43200  1.0 3.0
   34    33    47    50   0.15000  1.0 3.0
   38    33    47    45   0.34400  1.0 1.0
   38    33    47    45   0.09450 -1.0 2.0
   38    33    47    45   0.11100  1.0 3.0
   38    33    47    49   0.21200  1.0 1.0
   38    33    47    49   0.16900 -1.0 2.0
   38    33    47    49  -1.15100  1.0 3.0
   38    33    47    50   0.34400  1.0 1.0
   38    33    47    50   0.09450 -1.0 2.0
   38    33    47    50   0.11100  1.0 3.0
   38    40    42    43   0.00000  1.0 1.0
   38    40    42    44   0.00000  1.0 1.0
   38    40   -42    45   0.09850  1.0 1.0
   38    40   -42    45   0.15250 -1.0 2.0
   38    40   -42    45  -0.50650  1.0 3.0
   39    38    40    41   7.00000 -1.0 2.0
   39    38    40    42   7.00000 -1.0 2.0
   40    42    45    46   0.15000  1.0 3.0
   40    42    45    47   0.34400  1.0 1.0
   40    42    45    47   0.09450 -1.0 2.0
   40    42    45    47   0.11100  1.0 3.0
   40    42    45    48   0.61850  1.0 1.0
   40    42    45    48  -0.22750 -1.0 2.0
   40    42    45    48   0.15300  1.0 3.0
   41    40    42    43   0.00000  1.0 1.0
   41    40    42    44   0.00000  1.0 1.0
   41    40    42    45   0.09700  1.0 1.0
   41    40    42    45   0.15600 -1.0 2.0
   41    40    42    45  -0.50800  1.0 3.0
   42    45   -47    33   0.56750  1.0 1.0
   42    45   -47    33  -0.07550 -1.0 2.0
   42    45   -47    33   0.20000  1.0 3.0
   42    45    47    49  -0.03700  1.0 1.0
   42    45    47    49   0.37200 -1.0 2.0
   42    45    47    49  -0.47300  1.0 3.0
   42    45    47    50   0.56750  1.0 1.0
   42    45    47    50  -0.07550 -1.0 2.0
   42    45    47    50   0.20000  1.0 3.0
   42    45    48    71  -0.32850  1.0 1.0
   42    45    48    71  -0.35800 -1.0 2.0
   42    45    48    71   0.33950  1.0 3.0
   43    42    45    46   0.15000  1.0 3.0
   43    42    45    47   0.15000  1.0 3.0
   43    42    45    48   0.23400  1.0 3.0
   44    42    45    46   0.15000  1.0 3.0
   44    42    45    47   0.15000  1.0 3.0
   44    42    45    48   0.23400  1.0 3.0
   45    47    49    53   0.04150 -1.0 2.0
   45    47   -49    71   0.04150 -1.0 2.0
   45    47    50    64   0.56750  1.0 1.0
   45    47    50    64  -0.07550 -1.0 2.0
   45    47    50    64   0.20000  1.0 3.0
   45    47    50    51   0.15000  1.0 3.0
   45    47    50    52   0.15000  1.0 3.0
   46    45    47    33   0.15000  1.0 3.0
   46    45    47    49   0.43200  1.0 3.0
   46    45    47    50   0.15000  1.0 3.0
   46    45    48    71   0.08050  1.0 3.0
   47    33    38    39   0.00000  1.0 1.0
   47    33   -38    40   0.09850  1.0 1.0
   47    33   -38    40   0.15250 -1.0 2.0
   47    33   -38    40  -0.50650  1.0 3.0
   47    45   -48    71  -0.32850  1.0 1.0
   47    45   -48    71  -0.35800 -1.0 2.0
   47    45   -48    71   0.33950  1.0 3.0
   47    49    53    54   3.62500 -1.0 2.0
   47    49    53    56   3.62500 -1.0 2.0
   47    49    71    63   3.62500 -1.0 2.0
   47    49   -71    48   3.62500 -1.0 2.0
   49    47    50    64  -0.03700  1.0 1.0
   49    47    50    64   0.37200 -1.0 2.0
   49    47    50    64  -0.47300  1.0 3.0
   49    47    50    51   0.43200  1.0 3.0
   49    47    50    52   0.43200  1.0 3.0
   49    53    54    55   3.62500 -1.0 2.0
   49    53    54    59   3.62500 -1.0 2.0
   49    53    56    57   0.00000  1.0 1.0
   49    53    56    58   0.00000  1.0 1.0
   49    53    56    61  -0.46400 -1.0 2.0
   49    71   -48    45   1.63200 -1.0 2.0
   53    49    71    63   3.62500 -1.0 2.0
   53    49    71    48   3.62500 -1.0 2.0
   53    54    59    60   3.62500 -1.0 2.0
   53    54   -59    63   3.62500 -1.0 2.0
   53    56    61    62   0.17350  1.0 3.0
   53    56    61    64   0.03550  1.0 1.0
   53    56    61    64   0.09800 -1.0 2.0
   53    56    61    67   0.03550  1.0 1.0
   53    56    61    67   0.09800 -1.0 2.0
   54    53    56    57   0.00000  1.0 1.0
   54    53    56    58   0.00000  1.0 1.0
   54    53    56    61  -0.46400 -1.0 2.0
   54    59    63    71   3.62500 -1.0 2.0
   54    59    63    72   3.62500 -1.0 2.0
   55    54    59    60   3.62500 -1.0 2.0
   55    54    59    63   3.62500 -1.0 2.0
   59    63   -71    49   3.62500 -1.0 2.0
   59    63    71    48   3.62500 -1.0 2.0
   59    63    72    73   1.63200 -1.0 2.0
   60    59    63    71   3.62500 -1.0 2.0
   60    59    63    72   3.62500 -1.0 2.0
   63    71    48    45   1.63200 -1.0 2.0
   63    72    73    74   0.08050  1.0 3.0
   63    72    73    75   0.08050  1.0 3.0
   63    72    73    76   0.08050  1.0 3.0
   71    49   -53    54   3.62500 -1.0 2.0
   71    49    53    56   3.62500 -1.0 2.0
   71    63    72    73   1.63200 -1.0 2.0
   48    45    47    33   0.62750  1.0 1.0
   48    45    47    33  -0.30950 -1.0 2.0
   48    45    47    33   0.27300  1.0 3.0
   48    45   -47    49  -0.64350  1.0 1.0
   48    45   -47    49  -0.04200 -1.0 2.0
   48    45   -47    49   0.19800  1.0 3.0
   48    45    47    50   0.62750  1.0 1.0
   48    45    47    50  -0.30950 -1.0 2.0
   48    45    47    50   0.27300  1.0 3.0
   72    63    71    49   3.62500 -1.0 2.0
   72    63    71    48   3.62500 -1.0 2.0
   56    53    54    55   3.62500 -1.0 2.0
   56    53    54    59   3.62500 -1.0 2.0
   56    61    64    65   0.15000  1.0 3.0
   56    61    64    66   0.15000  1.0 3.0
   56    61    64    50   0.47100  1.0 1.0
   56    61    67    68   0.15000  1.0 3.0
   56    61    67    69   0.15000  1.0 3.0
   56    61    67    70   0.15000  1.0 3.0
   57    56    61    62   0.13050  1.0 3.0
   57    56    61    64   0.15000  1.0 3.0
   57    56    61    67   0.15000  1.0 3.0
   58    56    61    62   0.13050  1.0 3.0
   58    56    61    64   0.15000  1.0 3.0
   58    56    61    67   0.15000  1.0 3.0
   61    64    50    47   1.36600  1.0 1.0
   61    64    50    47  -0.11450 -1.0 2.0
   61    64    50    47   0.24250  1.0 3.0
   61    64    50    51   0.19200  1.0 3.0
   61    64    50    52   0.19200  1.0 3.0
   62    61    64    65   0.13050  1.0 3.0
   62    61    64    66   0.13050  1.0 3.0
   62    61    64    50   0.17350  1.0 3.0
   62    61    67    68   0.13050  1.0 3.0
   62    61    67    69   0.13050  1.0 3.0
   62    61    67    70   0.13050  1.0 3.0
   64    61    67    68   0.15000  1.0 3.0
   64    61    67    69   0.15000  1.0 3.0
   64    61    67    70   0.15000  1.0 3.0
   65    64    50    47   0.15000  1.0 3.0
   65    64    50    51   0.15000  1.0 3.0
   65    64    50    52   0.15000  1.0 3.0
   66    64    50    47   0.15000  1.0 3.0
   66    64    50    51   0.15000  1.0 3.0
   66    64    50    52   0.15000  1.0 3.0
   50    47    49    53   0.04150 -1.0 2.0
   50    47    49    71   0.04150 -1.0 2.0
   67    61    64    65   0.15000  1.0 3.0
   67    61    64    66   0.15000  1.0 3.0
   67    61    64    50   0.47100  1.0 1.0
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
   33    39    38    40   1.10000 -1.0 2.0
   42    41    40    38   1.10000 -1.0 2.0
   53    71    49    47   4.00000 -1.0 2.0
   54    56    53    49   4.00000 -1.0 2.0
   59    55    54    53   1.10000 -1.0 2.0
   63    60    59    54   1.10000 -1.0 2.0
   71    72    63    59   4.00000 -1.0 2.0
   63    48    71    49   4.00000 -1.0 2.0
END
