IFLAB-ZINC04342070 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3720 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 1.2160 -0.6850 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 0.0220 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 1.3990 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 3.5600 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 4.1560 0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -2.0780 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 -2.7440 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 -4.1220 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -4.8520 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -5.4300 -0.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 -4.8420 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7570 -4.2220 -0.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7250 -6.1900 -0.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0020 -6.9080 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7390 -8.4150 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0840 -8.7810 -1.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9000 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 3.3550 -0.5090 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3330 1.9470 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -2.5720 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3450 -2.1940 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 -6.6840 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5620 -6.6340 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5790 -6.6430 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6860 -8.9500 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1040 -8.6760 0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 -9.7250 -1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 4.2470 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 5.2120 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 2 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 3 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 32 33 1 0 0 0 0 M END