IFLAB-ZINC05251399 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 0.0250 1.1470 -0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -0.0940 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -0.6030 0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2990 0.1260 0.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 1.3730 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 1.8810 -0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 2.1140 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4760 3.4580 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 4.0190 0.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 4.2580 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7920 3.6970 -0.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6860 5.6020 0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9170 6.3860 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5900 7.8740 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8560 8.6810 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2720 9.1240 -1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4330 9.8640 -1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1800 10.1620 -0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7630 9.7180 0.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5990 8.9820 1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3160 10.8860 -0.4390 F 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 -0.4190 1.2300 N 0 3 0 0 0 0 0 0 0 0 0 0 3.4580 -1.4690 1.8450 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5700 0.1830 1.1480 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8620 1.5390 -1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.6660 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 -1.5720 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 2.8500 -1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3770 1.6610 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8380 6.0500 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6150 6.0930 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3690 6.2020 -1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8920 8.1670 -0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1380 8.0580 1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6890 8.8910 -2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7570 10.2100 -2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3460 9.9500 1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2720 8.6390 2.0040 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 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 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END