PUBCHEM-ZINC05631237 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3060 0.0090 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 1.3170 -0.7400 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 -1.6760 1.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 -2.4470 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 -2.3660 0.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5070 -3.3860 2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5380 -4.1920 2.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3830 -5.0130 3.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2860 -5.9610 4.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 -6.6700 5.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7340 -6.4780 6.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -5.5650 5.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 -4.8240 4.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 -3.5970 3.6090 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9160 -7.6570 6.0300 N 0 3 0 0 0 0 0 0 0 0 0 0 5.9900 -7.8300 5.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6290 -8.2960 7.0260 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9120 1.8580 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8330 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -1.2910 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -0.0240 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -1.7400 1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4300 -4.2120 2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2410 -6.1230 3.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -7.0480 6.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -5.4200 6.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 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 21 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END