PUBCHEM-ZINC05973866 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 38 0 0 1 0 0 0 0 0999 V2000 0.3640 1.3910 -0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 0.3350 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 0.2160 1.2080 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 1.1620 1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 1.8910 0.1400 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 2.8800 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7760 2.9190 1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 1.7290 2.5340 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8070 3.9690 1.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5480 4.7640 0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 3.8890 -0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -0.6160 -0.6090 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3320 -1.4780 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 -1.0870 -2.0450 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2250 -1.8440 -2.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3250 -1.3110 -3.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4330 0.0720 -3.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3110 0.8250 -1.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 0.1890 -0.3370 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7580 0.8610 -4.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2030 2.0410 -4.2050 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1620 -2.0160 -2.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -3.0810 -1.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 1.7800 -1.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 4.6070 2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8120 3.5360 1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0050 5.6880 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4850 5.0640 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 3.4280 -1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 4.4760 -1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 -2.9460 -2.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 -0.2500 -2.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4430 1.9020 -1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5300 0.2410 -5.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -1.6130 -2.6530 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 2 0 0 0 0 22 23 2 0 0 0 0 22 35 1 0 0 0 0 M CHG 1 21 -1 M CHG 1 35 -1 M END