PUBCHEM-ZINC04132215 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 -0.0030 1.3770 0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -0.0050 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 0.0290 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3630 1.4120 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.5920 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2140 3.9580 -0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 4.1120 1.4260 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3960 5.1990 1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 3.5910 2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 3.6650 3.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 3.5810 3.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 3.4360 1.9580 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5630 2.3720 1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7670 3.9860 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0040 4.2000 1.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0430 4.7050 1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8440 4.9960 -0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6080 4.7900 -0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5550 4.2900 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2980 4.1230 -0.7570 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6210 4.9780 1.7380 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 5.9610 0.9440 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3930 5.1320 3.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4940 3.5820 1.5590 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 -2.1590 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1950 -2.7830 0.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 -2.7530 -0.1850 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9350 1.9040 0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -0.5580 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3140 -0.4970 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2800 1.9650 -0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 4.2390 2.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 2.5640 2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 3.7690 4.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 3.6280 4.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1620 3.9740 2.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6580 5.3860 -0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4580 5.0180 -1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 4.3600 -1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0990 2.8170 1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3990 3.5280 1.9020 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 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 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END