ENAMINE-ZINC05271308 MOE2007 3D Structure written by MMmdl. 54 56 0 0 0 0 0 0 0 0999 V2000 1.9930 -1.1490 1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 -0.1340 1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 1.2810 1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 2.2720 1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8980 1.2510 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 2.7080 1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1830 1.8800 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 0.6260 1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 -0.4520 1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5570 2.2690 1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0770 3.3750 1.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2320 1.0960 0.9920 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6660 1.1750 0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1760 -0.2570 0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3660 -1.1770 1.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5310 -0.5110 0.6050 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.8710 -1.9480 0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4850 -2.5120 1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9490 -2.2370 3.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5180 -2.7880 4.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6200 -3.6320 4.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1510 -3.9320 2.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5840 -3.3810 1.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6280 0.5080 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4760 1.0300 -1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0620 -0.0830 0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6210 1.6860 1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6620 -0.9980 0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5820 -1.0730 2.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 -2.1710 1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 1.5180 1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 3.3250 1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9570 3.7760 1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -1.4730 1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0060 1.6170 1.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9600 1.7560 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5170 -2.1030 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9810 -2.5510 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0790 -1.5950 3.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0980 -2.5620 5.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0620 -4.0610 5.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0050 -4.5970 2.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0110 -3.6340 0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5500 0.2060 -1.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2580 1.7580 -1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5150 1.5170 -1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2740 -0.4510 1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8190 0.6800 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2370 -0.8940 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8580 2.4320 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5690 2.2370 1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4700 1.3330 2.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 0.5750 1.1170 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.2660 -0.2560 1.0590 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 9 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 10 1 0 0 0 0 7 53 1 0 0 0 0 8 9 1 0 0 0 0 8 53 2 0 0 0 0 9 34 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 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END