CHEMDIV-ZINC04529336 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 0.1070 1.5560 0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 0.0280 0.1510 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9280 -0.3480 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -0.5740 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 -0.4830 0.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4970 -0.4550 1.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 -0.4350 -0.9820 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6580 -1.2910 -1.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -0.4890 -1.1940 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3270 -1.5120 -1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 0.4280 -2.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 0.3440 -2.5290 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9600 0.3810 -1.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 0.2370 -3.6490 O 0 5 0 0 0 0 0 0 0 0 0 0 2.7470 0.8660 -1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2500 0.8560 -1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8140 -0.0940 -0.9590 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 1.9070 0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 1.9570 -0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 1.8950 1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 0.0120 2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 -1.6130 1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 1.4560 -2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 0.1170 -3.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 0.9510 -2.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 1.7130 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9630 1.9020 -1.8960 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9240 1.8500 -1.8040 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 9 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 16 17 2 0 0 0 0 16 27 1 0 0 0 0 27 28 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M END