NCID-ZINC01737829
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 19  0  0  1  0  0  0  0  0999 V2000
    0.0850    1.4860    0.0240 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0560   -0.0510   -0.0450 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.6920   -0.4940    0.7300 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3790   -0.5770    0.0990 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.8710   -0.1070    0.9600 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6000   -2.1070    0.2850 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5950   -2.4890   -0.4250 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5770   -0.4730   -1.4350 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3160   -0.3610   -2.3510 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4470    2.0840    0.3900 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9440    1.6770    1.4770 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2580    1.9320   -0.9190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6070    1.8360    0.8010 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8660   -2.7270    1.0890 O   0  5  0  0  0  0  0  0  0  0  0  0
   -2.2060   -0.1520   -1.1020 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.8440   -0.9710   -1.2360 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5110   -0.1960   -1.9350 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6570    0.7570   -1.0600 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7600   -0.8840   -1.5100 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.8640    2.9780   -0.4010 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 10  1  0  0  0  0
  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  8  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  4 15  1  0  0  0  0
  6  7  2  0  0  0  0
  6 14  1  0  0  0  0
  8  9  2  0  0  0  0
  8 19  1  0  0  0  0
 10 11  2  0  0  0  0
 10 20  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 18  1  0  0  0  0
M  CHG  1  14  -1
M  CHG  1  15   1
M  CHG  1  19  -1
M  CHG  1  20  -1
M  END