ENAMINE-ZINC04864808 MOE2007 3D Structure written by MMmdl. 45 48 0 0 0 0 0 0 0 0999 V2000 -3.6770 4.4840 -0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 3.2270 -0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 3.0560 -0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 1.7180 -0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5160 1.1500 -0.1530 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4990 2.0710 -0.0390 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 -0.2090 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 -2.3830 -0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0990 -3.6250 -1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9710 -4.7020 -0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2400 -4.5240 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6990 -3.2620 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8250 -2.1950 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9410 -0.8250 0.2000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0980 -0.1690 0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 1.0480 -0.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 1.6620 -0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 2.7870 -0.8400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 0.8810 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 -0.5160 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 -1.1880 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 -0.4600 0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7910 0.9370 0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5870 1.6000 0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0840 -1.1710 0.7160 N 0 3 0 0 0 0 0 0 0 0 0 0 7.1130 -0.4950 0.8570 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0320 -2.4060 0.7850 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.5120 4.3860 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0800 4.7340 0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0540 5.3200 -0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 3.8390 -0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -3.7490 -1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6620 -5.7030 -1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8840 -5.3920 -0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6770 -3.1270 0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6190 0.4190 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7910 -0.9080 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7640 0.4650 1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 0.1140 0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 -1.1100 -0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 -2.2750 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6770 1.5230 0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5690 2.6890 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9830 -1.1370 -0.7100 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1230 -0.9390 -1.2100 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 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 14 1 0 0 0 0 7 44 2 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 8 44 1 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 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 1 0 0 0 0 14 15 1 0 0 0 0 15 36 1 0 0 0 0 15 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 25 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 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