NCID-ZINC05922410 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 30 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3770 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -0.6630 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 0.1420 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 1.4460 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 2.0840 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 -1.0270 -0.0380 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3690 -0.9210 -1.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3950 -0.9310 1.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8530 -2.4540 -0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5610 -2.0960 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -2.9320 -0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3670 -3.7550 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 -4.8050 0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1240 -6.0880 0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3830 -6.3290 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -5.2850 -0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 -4.0000 -0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9260 -7.7050 -0.0860 N 0 3 0 0 0 0 0 0 0 0 0 0 4.2650 -8.6250 0.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0350 -7.9180 -0.5440 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -0.5670 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 3.1640 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -4.6180 0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5400 -6.9050 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1170 -5.4760 -0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2140 -3.1860 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 18 28 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END