CHEMDIV-ZINC00543286 MOE2007 3D Structure written by MMmdl. 42 46 0 0 1 0 0 0 0 0999 V2000 4.9860 0.6550 -0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9950 -0.4240 -0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6160 0.0470 -0.1930 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -0.8340 -0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7110 -2.2280 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -3.0910 -0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 -2.5800 -0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -1.2070 -0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -0.3410 -0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 1.0810 -0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7670 3.1270 -0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 4.2460 -0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 5.4780 -0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 5.5660 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 4.4280 0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 3.2080 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 1.8980 -0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 1.4040 0.3210 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0490 2.1000 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 1.5520 1.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5340 2.2790 2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 2.1820 3.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 1.3860 4.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 0.7590 2.9350 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1710 1.3700 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9490 0.1990 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6330 1.2020 -1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3510 -0.9120 0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0210 -1.1680 -1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 -2.6840 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -4.1650 -0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 -3.2530 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8780 -0.8310 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6070 4.1650 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 6.3930 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 6.5480 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 4.4980 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3020 2.8550 1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0850 2.6690 4.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 1.1390 5.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 1.7870 -0.6800 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9190 1.4120 -0.9960 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 18 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 10 1 0 0 0 0 10 17 1 0 0 0 0 10 41 2 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 41 1 M END