ENAMINE-ZINC01510400 MOE2007 3D Structure written by MMmdl. 45 48 0 0 0 0 0 0 0 0999 V2000 -4.1230 4.5400 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6670 4.3980 -0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 3.3780 -0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 2.4530 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 2.9190 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 4.2650 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 5.1860 0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 4.6980 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 5.3040 -0.3290 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 6.6730 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 7.1580 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 8.4610 1.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8380 9.2590 0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2210 8.7580 -0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8790 7.4560 -0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 1.9740 -0.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9470 2.2180 0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4610 3.2830 0.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8030 1.0180 0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9860 0.2390 -0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8500 -0.8590 -0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5390 -1.1770 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3690 -0.4020 1.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4990 0.6930 1.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2890 1.4440 2.8350 N 0 3 0 0 0 0 0 0 0 0 0 0 6.2980 1.8230 3.4450 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1170 1.6020 3.2060 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.2250 5.0180 -2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5530 3.5360 -1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5720 5.1270 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 1.4350 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6970 4.6390 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 6.2170 0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 6.5360 1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8190 8.8560 2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1060 10.2750 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7770 9.3910 -1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 7.0950 -1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 1.0210 -0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4920 0.4890 -1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9990 -1.4630 -1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2130 -2.0310 0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9080 -0.6630 2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9870 3.2540 -1.0230 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.4020 2.4080 -1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 9 1 0 0 0 0 2 44 2 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 3 44 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M CHG 1 44 1 M END