IBS-ZINC00529392 MOE2007 3D Structure written by MMmdl. 50 53 0 0 0 0 0 0 0 0999 V2000 0.5070 0.8380 -3.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 0.2890 -2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 0.1220 -1.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -1.0250 -0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -2.2550 -1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -3.1880 -0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 -2.8970 0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6210 -1.6570 1.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.7430 0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 1.0420 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 2.3510 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 3.5130 -0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 3.7120 -0.4260 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 5.1050 -0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8690 5.8360 -0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 7.2270 -0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 7.8630 -0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 7.1240 -0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 5.7490 -0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 4.7640 -0.3240 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 5.0900 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5870 5.1190 -1.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6210 2.7940 -0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 2.6640 0.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 0.9390 -4.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 0.1750 -3.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 1.8210 -3.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 0.9580 -2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 -0.6800 -2.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 -2.4770 -2.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -4.1670 -0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 -3.6580 1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -1.4190 2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6400 2.3530 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8430 5.3640 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 7.8270 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 8.9460 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 7.6330 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1170 6.0530 0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4880 4.3560 0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6540 5.3520 -1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4840 4.1510 -2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 5.8760 -2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 3.1190 -1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 1.8070 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0670 1.9150 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5440 2.3610 1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7090 3.6120 1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 0.5420 0.9950 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3550 1.0430 1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 49 1 0 0 0 0 10 11 1 0 0 0 0 10 49 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 20 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END