ENAMINE-ZINC04013216 MOE2007 3D Structure written by MMmdl. 40 42 0 0 0 0 0 0 0 0999 V2000 -4.5010 -1.0070 0.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5150 -1.1020 -0.3580 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 -2.1350 -1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 -1.8540 -2.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 -0.1890 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 1.0010 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0510 1.4670 0.9370 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 1.6920 -0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 1.0090 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 1.6580 -0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 2.9080 -0.6550 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 3.5720 -0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 3.0100 -0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1490 3.7810 -0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 5.0750 -1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 5.6180 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 4.8640 -1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8930 0.7910 0.1670 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0970 2.1430 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5090 1.6570 0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8910 0.4950 0.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3230 2.7430 0.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6980 2.4230 0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1350 -0.1340 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1270 -1.9040 0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9800 -0.9240 1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1590 -2.9400 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -2.3380 -2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 0.0070 0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1500 3.3880 -0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9280 5.6590 -1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 6.6270 -2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 5.3030 -1.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0500 2.5380 -1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8650 2.9290 0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2460 3.3600 0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8090 1.8220 1.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1130 1.9000 -0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 -0.6640 -1.6860 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1030 -0.1950 -2.1430 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 2 5 1 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 28 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 39 2 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 39 1 M END