IFLAB-ZINC05257940 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 35 0 0 1 0 0 0 0 0999 V2000 -0.6930 2.0110 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 0.4990 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 -1.6570 -0.0590 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6540 -1.9070 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 -2.3300 0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8290 -1.9420 2.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 -1.1990 2.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8170 -2.4190 2.8320 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8160 -2.1490 4.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0180 -1.9910 4.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0130 -1.7240 6.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8140 -1.6130 6.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6170 -1.7700 6.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6150 -2.0420 4.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -1.6500 6.9780 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3380 -1.4130 8.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -1.7870 6.3860 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.4200 -2.1410 -1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 -1.3530 -2.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 2.5290 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 2.2880 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2250 2.2910 0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 0.2190 -1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 0.2220 0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6760 -2.0090 0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6650 -3.4130 0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5290 -2.9510 2.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9540 -2.0780 4.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9470 -1.6020 6.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8140 -1.4040 7.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 -2.1690 4.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 -0.2000 -0.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2860 0.0920 0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 -3.4470 -1.7290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 -3.7100 -2.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 18 1 0 0 0 0 3 32 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 32 33 1 0 0 0 0 34 35 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END