6BR
  CCTOOLS-0626261019

 21 20  0  0  1  0  0  0  0  0999 V2000
   -2.7660    1.3850    0.8910 N   0  0  0  0  0
   -2.3170    0.6490   -0.2990 C   0  0  0  0  0
   -2.5300   -0.8270   -0.0870 C   0  0  0  0  0
   -2.6550   -1.2650    1.0330 O   0  0  0  0  0
   -0.8300    0.9210   -0.5350 C   0  0  0  0  0
   -0.0690    0.3860    0.5490 O   0  0  0  0  0
   -0.5960    2.4310   -0.6270 C   0  0  0  0  0
   -2.5800   -1.6560   -1.1410 O   0  0  0  0  0
    1.6240   -0.1580    0.0790 V   0  0  0  0  0
    3.2590   -0.6830   -0.3740 O   0  0  0  0  0
    2.0100    1.4940   -0.4440 O   0  5  0  0  0
    0.9320   -1.3160   -1.0750 O   0  5  0  0  0
    1.9310   -0.6530    1.7570 O   0  5  0  0  0
   -3.7590    1.2730    1.0310 H   0  0  0  0  0
   -2.2510    1.0980    1.7090 H   0  0  0  0  0
   -2.8890    0.9780   -1.1670 H   0  0  0  0  0
   -0.5180    0.4480   -1.4660 H   0  0  0  0  0
   -0.9080    2.9040    0.3040 H   0  0  0  0  0
    0.4630    2.6240   -0.7950 H   0  0  0  0  0
   -1.1760    2.8390   -1.4540 H   0  0  0  0  0
   -2.7190   -2.5950   -0.9550 H   0  0  0  0  0
  1 14  1  0  0  0
  1 15  1  0  0  0
  2  5  1  0  0  0
  2  1  1  0  0  0
  2 16  1  0  0  0
  3  2  1  0  0  0
  3  8  1  0  0  0
  4  3  2  0  0  0
  5  6  1  0  0  0
  5 17  1  0  0  0
  6  9  1  0  0  0
  7  5  1  0  0  0
  7 18  1  0  0  0
  7 19  1  0  0  0
  7 20  1  0  0  0
  8 21  1  0  0  0
  9 11  1  0  0  0
  9 10  2  0  0  0
 12  9  1  0  0  0
 13  9  1  0  0  0
M  CHG  1  11  -1
M  CHG  1  12  -1
M  CHG  1  13  -1
M  END
$$$$
