PUBCHEM-ZINC05895752 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 1.7830 1.5230 -1.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 0.3650 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -0.1020 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 0.5770 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 1.7360 0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 2.2340 -0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 3.3880 -0.7150 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 4.3410 0.4350 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 5.7940 0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4070 6.9570 -0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 8.1100 -0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 8.0970 -0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 6.9440 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 5.7970 0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 9.3030 -0.6250 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0700 10.2820 -1.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 9.2750 -0.3420 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1140 -1.5900 0.3510 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -1.3960 1.7130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -1.4950 -0.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -2.8090 0.1800 N 0 5 0 0 0 0 0 0 0 0 0 0 1.5610 -2.7240 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9010 1.8740 -2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -0.1660 -2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 0.2120 2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 2.2370 1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2350 3.6770 -1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4800 6.9760 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1630 8.9980 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 6.9140 0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 4.9010 0.7300 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 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 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M CHG 1 21 -1 M END