IBS-ZINC06764326 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 -0.1620 1.6770 -0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 0.1590 -0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -0.5230 -0.0540 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0730 -0.1850 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 -2.0400 -0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 -0.1760 1.2010 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4400 -0.0680 1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2770 -0.2410 0.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8700 0.3030 2.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9790 0.4260 3.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2280 0.4480 2.8840 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9380 0.7780 4.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3100 0.9140 4.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7670 1.2450 5.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7020 1.3730 6.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2010 1.0640 5.5210 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.8130 1.6980 7.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1300 2.2060 7.9980 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2280 1.4580 7.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1620 1.4850 5.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5030 2.1810 7.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2640 0.0220 7.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1430 0.7330 2.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3950 0.9190 2.9850 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8310 2.1170 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 1.9930 -1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 2.0870 0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 -0.1910 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -0.1200 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2630 -2.5310 -0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 -2.3270 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 -2.4360 0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -0.0130 2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8450 0.3050 2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6230 0.8190 8.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0990 2.4780 7.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4640 2.4740 5.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8610 0.7470 5.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4940 3.2300 7.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4050 1.7050 7.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5730 2.1940 8.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2240 0.0270 9.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1740 -0.5010 7.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4100 -0.5730 7.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5270 0.3980 1.8180 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 2 0 0 0 0 M CHG 1 24 -1 M END