NCID-ZINC01682453
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 21 20  0  0  1  0  0  0  0  0999 V2000
   -0.1370    1.4740   -0.1020 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0610    0.0550   -0.0540 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6460   -0.5030   -1.1810 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.3990    0.2000   -1.5590 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3260   -1.8060   -0.7230 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.6100   -2.4930   -0.2540 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4100   -1.4570    0.2910 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5480   -1.0910    0.0170 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9290   -1.5980    1.5640 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8650   -1.2650    2.5890 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9310   -2.5010   -1.8210 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3270   -0.8390   -2.3500 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2800   -0.0410   -2.5590 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8670    1.9060   -0.0340 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6320    1.8240   -1.0100 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7160    1.8130    0.7610 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7360   -1.9260    2.5420 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1670   -0.2170    2.5060 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3740   -1.4090    3.5560 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2170   -2.4670   -2.5340 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -1.8820   -3.0080 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3 12  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5 11  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 17  1  0  0  0  0
 10 18  1  0  0  0  0
 10 19  1  0  0  0  0
 11 20  1  0  0  0  0
 12 13  2  0  0  0  0
 12 21  1  0  0  0  0
M  CHG  1  21  -1
M  END