IBS-ZINC04712189 MOE2007 3D Structure written by MMmdl. 49 51 0 0 0 0 0 0 0 0999 V2000 2.5580 9.1110 9.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 7.1940 7.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 6.7780 5.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 8.9600 5.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 9.3620 6.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 7.0200 3.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 7.5630 2.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 7.1090 1.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 5.0370 2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 5.4940 3.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 5.1480 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 3.6670 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 3.1520 -0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 1.7760 -0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 0.9540 -0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 1.5460 -0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 2.8780 -0.1730 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 8.6500 9.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6400 10.2000 9.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 8.7710 9.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 6.8390 7.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4350 6.7960 8.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 5.6960 5.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 7.0660 5.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 9.3160 4.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 9.3800 4.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 9.0570 7.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 10.4440 6.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5150 7.4650 3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 8.6580 2.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 7.2420 3.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 7.4990 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 7.4360 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 3.9470 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 5.3650 1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 5.0940 3.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 5.0420 4.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 5.4630 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 5.7050 -0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 3.7940 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 1.3460 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -0.1210 -0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 0.9470 -0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6080 8.7000 7.6220 N 0 3 0 0 0 0 0 0 0 0 0 0 3.5190 9.0480 7.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5420 7.4310 5.1570 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6380 7.0920 5.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 5.6090 1.3930 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4720 5.2200 1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 2 44 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 4 46 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 5 44 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 29 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 9 48 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 44 45 1 0 0 0 0 46 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 44 1 M CHG 1 46 1 M CHG 1 48 1 M END