IFLAB-ZINC05250771 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 32 0 0 0 0 0 0 0 0999 V2000 -0.0200 1.4200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.0080 -0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 -0.6040 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -2.1280 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -2.5660 1.2470 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -3.8770 1.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 -4.6950 0.6280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 -4.3240 2.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -3.5060 3.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -5.6350 2.9410 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -6.0450 4.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 -5.3570 5.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 -5.7660 6.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6830 -6.8580 6.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8350 -7.5460 5.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 -7.1460 4.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4270 -7.2930 7.5310 N 0 3 0 0 0 0 0 0 0 0 0 0 3.2940 -6.6880 8.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1710 -8.2550 7.4730 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0030 1.7950 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 1.7810 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 1.7750 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 -0.2920 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 -0.2860 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -2.5820 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -2.4340 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 -1.9120 1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -6.2930 2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 -4.5030 5.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7220 -5.2310 7.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4960 -8.3990 5.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 -7.6860 3.0860 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 3 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 28 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 17 1 0 0 0 0 15 16 1 0 0 0 0 15 31 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 M CHG 1 17 1 M CHG 1 19 -1 M END