PUBCHEM-ZINC06998042 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 0 0 0 0 0 0 0 0999 V2000 2.4570 1.2110 -0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 -0.1770 -0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 -0.7610 -0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 0.0150 0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 1.4000 0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 2.0080 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 3.4160 -0.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5350 4.2300 -0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5640 3.8780 -1.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 5.7060 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 6.4170 0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 6.4690 -0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5060 7.2600 -0.0960 N 0 3 0 0 0 0 0 0 0 0 0 0 4.8590 7.6500 1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 7.1660 1.1600 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6210 7.5380 -0.4880 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6340 8.3100 -0.0050 N 0 3 0 0 0 0 0 0 0 0 0 0 7.4640 8.8910 1.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6260 8.3290 -0.7330 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9590 -2.5510 -0.2720 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 -2.7130 -0.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -2.8810 -1.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 -3.1100 1.0530 N 0 5 0 0 0 0 0 0 0 0 0 0 1.0710 -2.7860 1.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3770 1.6320 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1030 -0.7960 -1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 -0.4510 0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.9910 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 3.8540 0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 6.1390 -1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 5.8370 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7800 5.9710 -1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3280 8.2950 1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 7.1420 -1.3710 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 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 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 M CHG 1 13 1 M CHG 1 17 1 M CHG 1 19 -1 M CHG 1 23 -1 M END