ENAMINE-ZINC00440803 MOE2007 3D Structure written by MMmdl. 40 42 0 0 0 0 0 0 0 0999 V2000 0.5080 -2.0870 -1.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 -1.5640 -1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 -0.2530 -0.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 0.5580 -0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 0.0100 -0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -1.3010 -0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 1.9410 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 2.8780 -0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 4.2000 -0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 4.6090 0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 3.6830 1.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 2.3660 1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 6.0020 1.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 6.2140 2.5810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 7.0600 0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 8.7430 1.0490 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 9.4720 0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1930 9.7690 1.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4430 10.3820 1.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9450 10.7190 0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1970 10.4400 -0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9400 9.8100 -0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2050 9.5430 -1.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0210 8.3260 -2.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -3.1070 -1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -2.1780 -1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 0.1330 -0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 0.6140 -0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 -1.7050 -1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 2.5890 -1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 4.8780 -1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 3.9810 2.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 1.6680 1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 6.9670 -0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 6.8930 0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8120 9.5260 2.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0180 10.6010 2.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9130 11.2030 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5880 10.7150 -1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 10.5590 -2.4710 O 0 5 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 25 1 0 0 0 0 2 3 2 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 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 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 13 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 M CHG 1 40 -1 M END