PUBCHEM-ZINC05509682 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0830 1.4660 0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -0.0480 0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 -0.4940 -1.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 -0.6190 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8710 -0.3770 -0.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 -1.0920 -2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7050 -1.2820 -2.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2090 -1.7250 -4.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5440 -1.8690 -4.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5910 -2.3230 -5.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2830 -2.4550 -6.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4510 -2.0920 -5.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6650 -2.8440 -7.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2830 -2.4100 -8.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 -2.7370 -9.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 -3.5130 -9.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9870 -3.9580 -8.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 -3.6480 -7.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 -4.1800 -6.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -2.2660 -11.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5290 -1.5800 -10.9960 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0010 -1.3010 -3.4250 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -0.8000 -2.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2760 -0.7440 -2.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 1.9540 0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 1.8240 -0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 1.7830 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -0.3780 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 -0.5080 0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4570 -1.0780 -2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3940 -1.6570 -3.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4700 -2.5290 -6.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1780 -1.7900 -8.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1930 -3.7780 -10.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -4.5630 -8.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -3.3980 -5.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 -5.0210 -6.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -4.5590 -5.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9420 -2.5940 -12.2520 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 2 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 M CHG 1 21 -1 M END