CHEMDIV-ZINC03896996 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 23 0 0 0 0 0 0 0 0999 V2000 -0.0250 1.3300 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -0.1280 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 -0.2580 -0.5620 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 1.4470 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 2.1600 0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5260 1.8610 -0.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9400 3.2260 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4580 3.3410 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9350 4.7690 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4530 4.9600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1310 3.9270 -0.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 1.4720 -1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 1.6650 0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -0.3440 1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -0.8110 -0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2370 1.1730 -0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4640 3.8900 -0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 3.5380 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9290 2.6610 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7810 3.0070 -1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4690 5.4430 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6170 5.0950 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8370 6.1500 0.1920 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 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 14 1 0 0 0 0 2 15 1 0 0 0 0 3 4 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 16 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 M CHG 1 23 -1 M END