NCID-ZINC04962329 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 49 0 0 1 0 0 0 0 0999 V2000 0.0500 1.2680 0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -0.1140 0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 -0.7030 0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5620 0.0910 0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 1.4900 0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 2.0640 0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6290 2.3910 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9420 2.5650 -1.5990 S 0 0 0 0 0 0 0 0 0 0 0 0 5.6030 3.3150 -1.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1430 3.7050 -2.8930 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5280 4.4990 -3.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5730 4.2410 -2.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5790 3.5640 -2.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6130 5.5150 -2.1930 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8380 6.2200 -1.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5330 7.5400 -1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2970 7.8240 -1.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1900 2.5750 -3.8150 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1640 2.7500 -5.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0520 3.8370 -5.7360 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3020 1.4390 -5.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5300 1.6520 -7.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8540 0.3580 -8.1540 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1230 -0.4320 -7.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9970 0.5580 -9.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1730 0.1600 -10.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0790 -0.7170 0.3470 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 1.7280 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -0.7330 1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -1.7850 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 3.1420 0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 3.3870 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5220 2.0110 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5510 4.1970 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 2.5910 -1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7770 6.0770 -2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4370 5.5590 -1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3950 6.4300 -2.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2680 1.6440 -3.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1380 0.8860 -5.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3900 0.8530 -5.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6310 2.1070 -7.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3380 2.3800 -7.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5370 8.1570 -0.6310 O 0 5 0 0 0 0 0 0 0 0 0 0 6.0350 1.0140 -10.3350 O 0 5 0 0 0 0 0 0 0 0 0 0 8.2010 -0.1730 -7.6920 N 0 3 0 0 0 0 0 0 0 0 0 0 8.1830 -1.1210 -7.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7790 0.4730 -7.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6680 -0.2340 -8.6580 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 46 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 46 49 1 0 0 0 0 M CHG 1 44 -1 M CHG 1 45 -1 M CHG 1 46 1 M END