CHEMBRIDGE-ZINC04011014 MOE2007 3D Structure written by MMmdl. 54 56 0 0 1 0 0 0 0 0999 V2000 3.3950 10.3180 -7.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6730 9.4860 -7.2380 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7620 8.8790 -8.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9190 10.3700 -7.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0170 11.0950 -5.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9380 10.1290 -4.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6900 9.2300 -4.6720 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7870 9.8190 -4.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5880 8.5270 -6.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9280 8.8010 -2.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9820 7.7480 -1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 6.1770 -2.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5610 7.2150 -3.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7930 5.8480 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 5.1350 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 3.8160 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 3.1140 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 1.8260 0.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 1.1130 0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 1.6740 0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 2.9460 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 3.6610 -0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2010 10.9460 -6.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 10.9720 -8.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 9.6650 -7.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8110 9.7410 -7.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9340 11.0990 -7.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9630 11.6470 -5.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2180 11.8410 -5.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9440 10.7370 -3.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8440 9.5100 -4.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3960 7.7880 -6.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6450 7.9750 -6.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0860 9.4880 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8700 9.3530 -2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 8.2410 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8650 7.1080 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4870 5.5110 -2.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 5.5870 -2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6620 7.8360 -3.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 6.6790 -4.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0100 6.4150 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 5.1640 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 5.7390 0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1770 3.1890 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 1.3670 1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 0.1180 1.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 1.1180 0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2960 3.3790 -0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 4.6430 -0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7650 8.1640 -3.5350 N 0 3 0 0 0 0 0 0 0 0 0 0 5.6120 7.6080 -3.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7630 6.8490 -1.0610 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9280 7.4290 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 51 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 51 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 11 53 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 12 53 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 13 51 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 53 1 0 0 0 0 15 16 2 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 22 50 1 0 0 0 0 51 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 51 1 M CHG 1 53 1 M END