IFLAB-ZINC04328168 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 29 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3560 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -0.6940 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 -0.0380 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 1.3580 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 2.0580 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5150 3.3470 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 3.4810 -0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3740 2.2940 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8270 2.0290 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7410 3.0430 -0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0880 2.7510 -0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5190 1.5370 -0.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6930 0.5530 0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3300 0.7570 0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 -2.4560 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0090 -2.8540 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1830 -4.3160 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 -5.4440 -0.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 1.8890 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3950 4.0380 -0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8000 3.5260 -0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0900 -0.4250 0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6600 -0.0520 0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4680 -2.4280 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4850 -2.4380 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 3 4 2 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 18 19 3 0 0 0 0 M END