PUBCHEM-ZINC04531043 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 46 0 0 1 0 0 0 0 0999 V2000 -0.5130 1.4500 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 -0.0240 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -0.5540 1.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -0.6760 -1.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -2.1250 -1.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4570 -2.5000 -0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5460 -2.5300 -1.0030 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6190 -3.6250 -0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 -2.0870 -2.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 -2.7490 -3.3880 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7150 -3.8380 -3.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -2.3700 -3.5480 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2910 -2.8260 -4.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -2.7260 -2.2600 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6280 -3.8180 -2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 -2.2610 -2.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -3.0100 -3.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 -3.9470 -3.7780 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2400 -2.4960 -2.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -2.2960 -4.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4960 -2.9250 -4.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9520 -3.8530 -4.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1610 -2.3240 -6.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 -1.8910 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9610 -2.6350 0.3490 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5770 -1.6450 1.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9280 -0.7300 2.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9560 -2.0220 2.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 1.8280 -0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 1.6510 -1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 1.9590 0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3000 -1.4880 -3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9140 -3.1510 -3.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5500 -2.4990 -1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 -2.4800 -6.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3330 -1.2570 -5.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1280 -2.8090 -6.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4350 -0.8170 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7590 -2.0450 1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6720 -1.9040 1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2570 -1.3630 2.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9650 -3.0530 2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -0.8820 -3.7930 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9140 -0.5900 -4.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -0.5990 -4.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 -0.3720 -2.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 20 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 43 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 40 1 0 0 0 0 28 41 1 0 0 0 0 28 42 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 43 46 1 0 0 0 0 M CHG 1 43 1 M END