PUBCHEM-ZINC03176596 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 1 0 0 0 0 0999 V2000 0.6780 2.3900 -0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 1.0070 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 0.5730 1.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -0.7670 1.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -1.1250 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -2.3530 -0.6750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -0.0190 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 -2.4780 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 0.0180 -2.5390 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3140 0.9740 -2.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 -0.1490 -3.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 -1.4060 -3.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 -1.5590 -3.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0920 -0.4540 -3.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5190 0.8030 -3.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 0.9560 -3.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2960 1.9860 -4.3170 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.4400 1.8510 -4.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7920 3.0940 -4.2780 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7870 -1.1180 -3.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -1.0820 -4.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -1.0540 -5.6940 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1690 -0.9550 -2.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2360 -0.8300 -2.2390 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 2.4270 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 2.6310 -1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 3.1140 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 1.0970 1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5010 -2.2690 -2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8130 -2.5420 -3.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1060 -0.5740 -4.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 1.9390 -3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -2.0740 -2.7420 H 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 7 2 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 20 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 20 33 1 0 0 0 0 21 22 3 0 0 0 0 23 24 3 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END