IFLAB-ZINC02451685 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 0.1420 1.3860 -0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 0.0050 -0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -0.6810 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 0.0240 0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 1.4060 0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 2.0860 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5150 2.2890 1.3660 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -2.0790 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 -2.7340 -0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4540 -2.1140 -0.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 -4.2080 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 -4.9230 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -6.3010 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 -6.9780 -0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 -6.2850 -0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 -4.8970 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9200 -4.1500 -0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5070 -3.9280 0.6400 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9230 -7.0180 -0.6170 N 0 3 0 0 0 0 0 0 0 0 0 0 4.9220 -8.2320 -0.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9770 -6.4080 -0.6250 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6750 1.9200 -1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 -0.5400 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0700 -0.5070 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 3.1660 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 -2.5770 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 -4.4020 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -6.8530 -0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 -8.0550 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4330 -3.7170 -1.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2690 -3.2340 -1.5280 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 30 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 30 31 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END