ENAMINE-ZINC04204647 MOE2007 3D Structure written by MMmdl. 27 27 0 0 0 0 0 0 0 0999 V2000 -2.9350 2.0090 -1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6870 1.5310 -1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 2.0280 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7340 3.0100 0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9850 3.4890 0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6030 2.9950 -0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9530 3.5100 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4470 3.0100 -2.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 1.4860 0.4130 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 1.8250 1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 2.6960 2.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 0.9700 1.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4620 1.5960 0.4160 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7940 0.5160 0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6210 -0.5370 1.4640 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5120 -1.0320 1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9690 0.8830 0.1930 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3940 1.6090 -2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 0.7660 -1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 3.4290 1.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4840 4.2540 0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 0.7720 -0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6110 1.0210 2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 -0.0710 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0080 1.7310 -0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8180 0.3490 0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4970 4.4030 -0.4750 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 18 1 0 0 0 0 2 3 2 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 17 25 1 0 0 0 0 17 26 1 0 0 0 0 M CHG 1 27 -1 M END