ACROSORGANICS-ZINC01704341 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 21 0 0 1 0 0 0 0 0999 V2000 0.0230 1.5300 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 0.0040 0.0410 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4950 -0.4010 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 -0.4340 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -0.7610 2.1410 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -0.5150 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 -0.2150 1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6160 -0.6990 1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0710 -1.4860 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 -1.8030 -1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9080 -1.3100 -0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7180 -2.6530 -2.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8910 -2.8910 -3.0940 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0540 1.8910 -0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 1.8640 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 2.0230 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9790 0.3960 1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 -0.4630 1.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0940 -1.8570 0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -1.5550 -1.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9190 -3.0640 -2.1020 O 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 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 3 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 17 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 2 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 21 2 0 0 0 0 M CHG 1 13 -1 M END