CHEMDIV-ZINC03896538 MOE2007 3D Structure written by MMmdl. 41 44 0 0 0 0 0 0 0 0999 V2000 5.7280 0.1920 4.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6130 1.9790 4.1990 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1630 2.0530 3.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2260 2.7790 1.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1070 2.8760 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 2.2510 1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 1.5400 2.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9590 1.4450 3.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 2.3670 0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 1.3570 0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 1.9800 -0.6300 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 1.4460 -1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6990 2.3160 -2.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4870 3.6890 -2.2680 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5070 4.1290 -1.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 3.2960 -0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 0.0030 0.5660 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 -0.8080 0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5180 -0.2720 1.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6110 -1.1010 1.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5090 -2.4760 1.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3160 -3.0230 0.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 -2.1940 0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6660 -0.0250 5.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9040 -0.1590 5.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7250 -0.3500 3.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1490 3.2730 1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2000 3.4360 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 1.0650 3.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 0.9060 4.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 0.3800 -1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 1.9420 -2.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 5.1990 -1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -0.5290 0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 0.7950 1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5400 -0.6730 1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3580 -3.1210 1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -4.0960 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3070 -2.6460 0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 3.5410 0.0280 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7830 4.4480 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 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 28 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 40 2 0 0 0 0 17 18 1 0 0 0 0 17 34 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 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 40 1 M END