PUBCHEM-ZINC05209154 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -0.7480 1.1120 S 0 0 3 0 0 0 0 0 0 0 0 0 1.2060 0.1780 2.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 -1.7820 1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 -1.2970 2.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1580 -2.1080 3.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 -3.4030 3.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6310 -3.8880 2.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -3.0750 1.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3450 -4.2720 3.8600 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.9840 -3.8450 4.8050 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5200 -5.4130 3.4720 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8910 -1.6800 0.4950 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9490 -1.0800 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 -1.4640 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3000 -0.8690 -0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0430 0.1080 -1.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 0.4930 -1.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6930 -0.1010 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 -0.2840 3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7250 -1.7290 4.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 -4.9000 1.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -3.4530 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8730 -2.6430 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4590 -2.2280 0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3180 -1.1680 -0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8610 0.5720 -2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5440 1.2570 -2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 0.1970 -1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 3 14 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 M CHG 1 11 1 M CHG 1 13 -1 M END