ENAMINE-ZINC04830401 MOE2007 3D Structure written by MMmdl. 45 47 0 0 0 0 0 0 0 0999 V2000 -4.0680 1.4670 2.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 1.2490 2.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 1.0090 3.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6210 0.7990 3.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 0.7790 2.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 0.5600 2.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 0.3650 3.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 0.3820 4.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 0.5950 4.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 0.1590 5.8820 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 0.0890 6.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3300 0.0160 5.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7460 -0.2230 6.4710 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1710 -1.5420 7.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2090 -0.9740 8.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 -0.3860 8.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6170 -1.1940 9.9130 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9830 -0.8140 11.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7630 -0.1280 11.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 0.2200 12.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7570 -0.1180 13.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9740 -0.8010 13.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6030 -1.1480 12.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9120 -1.8700 12.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3880 -2.2640 11.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5820 -2.0710 13.5320 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5800 1.6550 1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5180 0.5910 2.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2370 2.3170 3.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4410 0.3830 1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1530 2.1470 1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 0.9360 1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 0.5450 1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 0.6060 5.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6570 -2.3230 7.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0460 -1.9940 8.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4990 -1.7060 10.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 0.1520 10.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 0.7520 12.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 0.1480 14.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 -1.0530 14.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2850 -1.7600 14.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4610 -2.5740 13.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3680 0.1320 4.1460 N 0 3 0 0 0 0 0 0 0 0 0 0 4.2130 0.0780 3.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 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 44 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 44 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END