ENAMINE-ZINC05413458 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 0.8530 0.8570 -0.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -0.2070 0.0200 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7390 0.2240 0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 -0.6760 1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -0.5890 1.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -1.1570 2.2570 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -1.5560 3.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 -1.5690 3.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8160 -1.9750 5.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 -2.3600 6.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -2.3230 5.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -1.9480 4.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -2.8430 7.0410 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 -3.2490 6.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -3.7640 7.9030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -1.4090 7.9170 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 -0.3270 7.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 0.6990 8.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 1.2420 8.9800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 0.2050 9.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 -0.8430 8.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -1.6750 -0.9680 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 -0.8810 -2.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0320 -2.0210 -3.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 -2.4810 -3.9610 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 0.4460 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 1.3290 -1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 1.6550 -0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -1.2330 2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0640 -1.2820 3.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8870 -1.9920 5.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 -2.6840 6.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 -1.9580 4.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 0.1600 6.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4930 -0.7410 6.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 1.5290 7.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8300 0.2540 8.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 0.6730 10.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 -0.2480 10.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -1.6310 9.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -0.3720 8.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1630 -0.2760 -1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -0.2510 -2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2150 -2.3200 -2.6780 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 22 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 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 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 M CHG 1 44 -1 M END