PUBCHEM-ZINC05761041 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4530 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -0.0730 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -0.5360 1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 -0.6060 0.2150 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -0.2800 -1.7440 P 0 0 0 0 0 0 0 0 0 0 0 0 -3.9860 -0.6210 -1.7890 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3490 1.2670 -2.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 1.5910 -3.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1360 2.0910 -3.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6410 2.4200 -4.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8640 2.2500 -5.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5790 1.7520 -5.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 1.4260 -4.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4070 2.6030 -7.1830 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.5390 3.0420 -7.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7230 2.4540 -8.1790 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.7430 -1.2100 -2.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 -2.5420 -2.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9690 -3.1950 -3.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1610 -4.5490 -3.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 -5.2550 -2.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -4.6070 -1.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 -3.2540 -1.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5320 -6.7060 -2.0110 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.4410 -7.2770 -2.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 -7.3280 -1.2680 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0220 1.7810 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 1.7750 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 1.8900 0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 -0.5100 -0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -0.0990 2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -1.6230 1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -0.2160 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7450 2.2240 -2.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6450 2.8100 -4.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9730 1.6190 -6.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0620 1.0410 -4.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 -2.6440 -3.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9670 -5.0570 -3.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 -5.1600 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 -2.7490 -1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M CHG 1 24 1 M CHG 1 26 -1 M END