ENAMINE-ZINC05004321 MOE2007 3D Structure written by MMmdl. 27 28 0 0 0 0 0 0 0 0999 V2000 2.1000 8.4280 0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 7.6830 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4880 6.3330 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 5.7170 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7070 6.4730 -1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0410 7.8240 -1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 4.3650 -0.1780 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 3.5190 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 2.0550 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 1.6000 -0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 0.2330 -0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 -0.6750 -0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 -0.1940 -0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9760 1.1780 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 -0.2520 -0.6470 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9930 0.5860 -0.6830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -1.4770 -0.7350 O 0 5 0 0 0 0 0 0 0 0 0 0 2.3600 9.4790 0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 8.1530 2.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 5.7510 2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 6.0010 -2.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 8.4030 -1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1140 3.8740 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 2.3190 -0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 -1.7470 -0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4650 -0.9200 -0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1900 1.5510 -0.0520 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 20 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 21 1 0 0 0 0 6 22 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M CHG 1 27 -1 M END