NCID-ZINC04204308
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 18  0  0  0  0  0  0  0  0999 V2000
   -0.4900    1.4560    0.0790 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2210   -0.0260    0.0340 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1260   -0.6900    1.1750 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3710   -2.0730    1.1080 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6820   -2.6980    2.1090 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2560   -2.6960   -0.0840 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4200   -3.6490   -0.1530 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0930   -1.9820   -1.1880 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3260   -0.6860   -1.1160 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2080   -2.6200   -2.3940 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2410    0.0330    2.4610 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.1350    1.2460    2.4890 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4420   -0.5840    3.4920 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.4520    1.9990   -0.0010 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1400    1.7320   -0.7510 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9750    1.7090    1.0210 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0420   -3.5740   -2.4550 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4560   -2.1190   -3.1860 H   0  0  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  2  0  0  0  0
  2  9  1  0  0  0  0
  3  4  1  0  0  0  0
  3 11  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
 10 17  1  0  0  0  0
 10 18  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
M  CHG  1  11   1
M  CHG  1  13  -1
M  END