ENAMINE-ZINC06881216 MOE2007 3D Structure written by MMmdl. 41 44 0 0 1 0 0 0 0 0999 V2000 0.6470 -5.1190 3.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9030 -5.6120 3.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 -4.9300 2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 -3.7330 2.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 -3.2180 2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -3.9260 3.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -2.0260 1.7350 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6370 -1.6470 0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 -2.6790 0.8980 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5720 -0.3880 0.1410 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8610 -0.5530 -0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 0.7530 0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 1.9970 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 1.6500 0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 -0.2240 -1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 -0.1550 -0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5740 -0.5630 0.3850 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8880 -0.5090 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7670 -0.0730 -0.3140 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2610 0.3190 -1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 0.2980 -1.7900 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1340 0.7780 -2.4300 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3600 -0.9380 1.7930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -5.6630 4.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 -6.5420 3.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -5.3190 2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 -3.5420 3.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 0.7210 1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 0.7270 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9110 2.1750 -0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 2.8920 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 2.1970 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 1.7860 1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 0.4210 -1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 -1.2630 -1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7750 1.0800 -3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1160 0.7990 -2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3540 -0.9060 1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7100 -1.2730 2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 0.1700 0.1250 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3330 -0.2970 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 40 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 40 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 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 40 1 M END