CHEMDIV-ZINC04678436 MOE2007 3D Structure written by MMmdl. 42 44 0 0 0 0 0 0 0 0999 V2000 0.1520 1.2210 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 1.5700 1.2250 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 1.6960 2.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 2.1090 3.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9380 1.8470 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7550 1.7780 0.1640 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1370 2.1470 0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9010 2.0200 -0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0030 3.1070 -1.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6920 2.9810 -2.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2900 1.7670 -3.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1670 0.6750 -2.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4800 0.7980 -1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1510 1.5470 -4.8710 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.3180 2.9340 -4.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 1.4380 2.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 0.1720 2.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0970 -0.0840 3.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8300 0.9190 3.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2670 2.1800 4.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9670 2.4400 3.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 0.1490 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 1.4790 0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 1.7810 -0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2760 2.3420 4.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 1.4850 -0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5710 1.4800 1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1880 3.1800 0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5480 4.0640 -1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7430 3.8380 -3.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6100 -0.2850 -2.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4060 -0.0700 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8930 2.9100 -3.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7940 3.8890 -4.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0140 2.8520 -5.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -0.6300 2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5390 -1.0680 3.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8410 0.7190 4.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8430 2.9600 4.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 3.4360 3.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2590 2.1920 2.4900 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.1830 2.4640 2.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 5 1 0 0 0 0 3 4 2 0 0 0 0 3 16 1 0 0 0 0 4 25 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 41 2 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 41 1 M END