ENAMINE-ZINC02276673 MOE2007 3D Structure written by MMmdl. 40 41 0 0 0 0 0 0 0 0999 V2000 6.1820 2.2320 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0260 1.2470 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 1.9630 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 0.9690 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 1.6840 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 0.7210 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -0.4930 0.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 1.4120 0.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 0.9100 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6260 1.6990 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8290 0.9230 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5330 -0.4270 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -0.7360 0.1980 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.2280 1.3300 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7510 2.0830 1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1000 2.4450 1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9340 2.0540 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4210 1.3050 -0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0720 0.9430 -0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5090 3.1570 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5590 3.8620 -0.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1370 1.6980 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1450 2.8150 -0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1570 2.9270 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1110 0.6580 0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0980 0.5470 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5980 2.5550 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6100 2.6640 0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5930 0.3740 0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 0.2650 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 2.2700 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 2.3760 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 2.4530 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2230 -1.2570 0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1050 2.4070 1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4960 3.0400 1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9820 2.3400 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0690 1.0070 -1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6820 0.3660 -1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 3.6190 -0.0860 O 0 5 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 2 25 1 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 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 M CHG 1 40 -1 M END