PUBCHEM-ZINC05644068 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 0 0 0 0 0 0999 V2000 -0.2120 1.2260 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -0.2970 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -0.9370 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -0.7560 -1.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9590 -0.8330 -1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5350 -0.5280 -0.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7440 -1.3010 -2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 -1.2960 -1.8830 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7970 -2.3460 -0.9670 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2570 -1.8620 -3.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5520 -3.2040 -3.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1350 -3.6480 -4.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4220 -2.7510 -5.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1270 -1.4100 -5.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5400 -0.9670 -4.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2180 0.4680 -4.2210 N 0 3 0 0 0 0 0 0 0 0 0 0 5.3740 1.2410 -5.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7990 0.8760 -3.1530 O 0 5 0 0 0 0 0 0 0 0 0 0 7.0480 -3.2260 -6.9760 N 0 3 0 0 0 0 0 0 0 0 0 0 7.3090 -4.4070 -7.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3010 -2.4360 -7.8670 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7770 1.6810 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 1.5100 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 1.5700 0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -0.5820 0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0300 -0.6520 -0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -2.0220 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 -0.5920 1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 -2.3120 -2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5580 -0.6320 -3.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3270 -3.9040 -2.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3660 -4.6950 -4.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3520 -0.7090 -6.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 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 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M CHG 1 19 1 M CHG 1 21 -1 M END