ENAMINE-ZINC04829842 MOE2007 3D Structure written by MMmdl. 45 47 0 0 1 0 0 0 0 0999 V2000 1.1430 4.1030 5.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 2.6780 5.6340 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4870 2.2160 5.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 1.8570 6.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 1.7800 7.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 1.2770 7.3140 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 0.4620 8.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3230 -0.0180 8.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 -0.8420 9.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6430 -1.2060 10.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 -0.7140 10.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 0.1110 9.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 -2.0770 11.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9530 -2.9890 11.5290 F 0 0 0 0 0 0 0 0 0 0 0 0 3.4320 -1.3550 12.8660 F 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 -2.7940 12.2640 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 2.6730 4.8710 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 3.0930 5.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 2.4470 3.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 2.2460 3.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 1.7080 2.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 1.4930 2.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 1.4370 1.3580 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 1.6360 1.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2920 1.3610 -0.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 2.1620 2.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0380 2.4060 1.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 0.8890 0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 4.1150 6.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 4.6990 5.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 4.5970 6.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6050 1.4380 6.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1190 0.2380 7.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6560 -1.2010 9.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -0.9730 11.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 0.4590 9.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 3.4780 6.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2450 3.4710 1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3490 2.1290 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6180 1.8150 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -0.0830 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 0.7620 0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 1.5590 -0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6560 2.9640 4.3800 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.6360 3.2100 4.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 17 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 32 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 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 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 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 37 1 0 0 0 0 18 44 2 0 0 0 0 19 20 2 0 0 0 0 19 26 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 38 1 0 0 0 0 27 39 1 0 0 0 0 27 40 1 0 0 0 0 28 41 1 0 0 0 0 28 42 1 0 0 0 0 28 43 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END