ENAMINE-ZINC05071552 MOE2007 3D Structure written by MMmdl. 45 47 0 0 0 0 0 0 0 0999 V2000 -0.1470 3.3250 -3.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 2.0700 -4.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 0.8770 -3.7930 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 0.3600 -4.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 0.8000 -5.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7340 0.0150 -6.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1600 -1.1460 -5.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -1.5930 -4.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 -0.8010 -3.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 0.0720 -2.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 0.2490 -1.4410 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 0.8800 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 1.2250 1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 1.7090 2.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 2.0850 3.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 2.0420 3.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 2.4590 4.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 2.9180 5.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 2.9620 5.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 2.5470 4.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4730 -2.1160 -6.2330 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4870 -3.3910 -5.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 -2.0090 -7.6700 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8410 -1.2710 -5.7180 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 3.2690 -2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 3.4650 -3.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 4.2050 -3.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 2.1500 -5.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 1.9470 -3.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 1.6930 -6.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2240 0.3130 -7.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8490 -2.4910 -3.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 0.1280 0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 1.7670 -0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 2.0060 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 0.3280 1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 1.6920 3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3020 2.4260 5.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 3.2410 6.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 3.3200 6.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 2.5840 3.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4150 -1.8340 -5.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6820 -0.3270 -5.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -0.9300 -2.7800 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7340 -1.6730 -2.0910 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 21 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 44 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 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 13 36 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END