IBS-ZINC02413271 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 40 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -0.4080 1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -1.9280 1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7760 -2.2690 2.9440 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2920 -1.7880 3.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7770 -3.7620 3.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8230 -4.3650 3.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1570 -1.7910 2.8340 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8640 -1.5100 3.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 -1.6540 5.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1340 -1.0700 3.8440 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9020 -0.7650 5.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3020 -0.2880 4.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0930 0.0260 5.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0070 -0.8900 6.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7330 -0.6020 7.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5450 0.6010 8.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6320 1.5170 7.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9080 1.2330 6.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0190 2.1300 6.0780 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 0.0240 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -0.0010 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.3610 1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -2.3350 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 -1.6760 1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5390 -0.9550 2.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3970 0.0190 5.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9830 -1.6610 5.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8080 -1.0720 4.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2220 0.6080 4.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1540 -1.8300 5.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4470 -1.3180 7.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1130 0.8250 9.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4850 2.4570 8.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -4.4230 3.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -5.3800 3.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 9 10 1 0 0 0 0 9 29 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 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 39 40 1 0 0 0 0 M END