PUBCHEM-ZINC05828605 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 29 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -1.9980 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 -2.6630 1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5160 -1.7980 2.4240 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8480 -4.4250 1.0200 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 2.0550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 3.5850 0.0080 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7940 3.9450 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8030 4.1070 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2750 4.8040 0.7410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 4.0590 1.2680 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 4.7950 1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 5.2180 -0.2770 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 5.3640 2.7710 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8760 -2.8880 3.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4200 -4.6840 2.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 1.6940 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 1.7040 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1040 5.9890 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 6.0880 2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5330 3.7990 -1.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4300 4.1570 -1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 23 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 11 29 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 29 30 1 0 0 0 0 M END