PUBCHEM-ZINC06824116 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 -0.2550 1.4930 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0110 0.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9480 -0.5360 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -0.2900 1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 -0.7390 1.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -0.0390 2.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -0.3320 3.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -0.7750 -2.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -1.3260 -3.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 -1.6400 -4.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6890 -1.4060 -4.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 -0.8570 -3.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 -0.5460 -2.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 -1.7430 -5.5900 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0330 -2.2260 -6.5880 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7360 -1.5370 -5.5520 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6940 2.0180 -0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 1.6940 -0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 1.8390 0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5310 -1.3920 3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1860 0.2610 3.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -0.0840 4.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 -1.5080 -3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -2.0690 -5.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3250 -0.6740 -3.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 -0.1210 -1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 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 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END