IBS-ZINC04858076 MOE2007 3D Structure written by MMmdl. 46 48 0 0 0 0 0 0 0 0999 V2000 7.1550 1.2550 -2.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3330 0.4340 -1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5110 2.2410 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8390 1.5060 0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0280 2.0100 0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8320 1.0570 0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6610 1.7550 0.9930 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 1.0290 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 1.6110 1.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 0.8420 1.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 1.6970 2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 1.4990 2.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 2.5920 3.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 3.8630 3.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 4.0830 2.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 2.9810 2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 2.9000 2.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6440 3.6890 1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3510 2.3820 3.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -0.4880 1.6770 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -0.9730 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4670 -0.3040 0.9800 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2040 1.7950 -2.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9670 1.9740 -2.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1570 0.5910 -3.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2710 -0.1270 -1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5320 -0.3030 -1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4480 2.9700 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3890 2.7660 1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8430 0.6980 0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0760 1.0840 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6450 2.2000 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8740 2.7580 -0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1740 2.5370 1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0990 0.2410 1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6010 0.6250 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 2.7480 1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 0.5020 2.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9390 4.7070 3.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 5.0740 2.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3760 2.1530 4.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9560 3.2760 3.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8170 1.5580 3.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 -2.0380 1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3380 1.2800 0.0740 N 0 3 0 0 0 0 0 0 0 0 0 0 7.4590 0.6100 0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 45 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 22 2 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END