PUBCHEM-ZINC02764181 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 0 0 0 0 0 0999 V2000 -0.3450 1.6060 0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 0.1600 0.1240 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -0.8570 0.0220 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 -2.1710 -0.1030 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 -0.4710 1.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2630 -0.5030 -1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 -1.1800 -2.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 -0.9050 -3.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5510 0.0520 -3.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9080 0.7300 -2.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2670 0.4470 -1.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2020 0.3330 -5.0870 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6330 1.5840 -5.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3720 2.4880 -4.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4190 1.8560 -6.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9300 3.0780 -6.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5920 2.8240 -8.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4680 1.5480 -8.4290 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7850 0.9540 -7.5170 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5660 0.0100 -7.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8020 4.3780 -6.2640 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.3090 5.3770 -6.7420 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1910 4.4470 -5.2130 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6210 2.1080 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 1.9610 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 1.8270 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 -0.2030 0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 -1.9230 -2.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 -1.4330 -4.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6900 1.4750 -2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5480 0.9710 -0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3430 -0.3720 -5.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1150 3.5510 -8.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END