IBS-ZINC04028026 MOE2007 3D Structure written by MMmdl. 46 49 0 0 0 0 0 0 0 0999 V2000 -2.5070 0.9630 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 1.7450 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 3.1310 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 3.8570 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 3.1800 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 1.7840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 1.0760 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 1.1220 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 3.9530 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4810 3.4040 0.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 5.3950 -0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 6.0770 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 7.4360 -0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 8.1210 -0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4960 7.4540 -0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5540 6.0930 -0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7450 5.4450 -0.6200 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7600 8.2080 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2850 6.8030 -3.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4630 6.8010 -4.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 7.7210 -4.9770 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2480 9.0630 -4.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0780 9.0880 -3.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 9.4500 -1.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 5.3360 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 5.9340 0.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8130 0.7690 1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2820 1.5380 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 0.0170 -0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 3.6460 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 0.9350 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 7.9620 -0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9780 5.0780 -1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6590 9.2430 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6010 7.7450 -0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2010 6.4500 -2.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4580 6.1470 -2.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5300 7.1030 -5.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7350 5.8000 -4.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3380 9.4310 -5.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0890 9.6980 -4.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8300 10.0990 -2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0070 8.7720 -2.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 9.6560 -2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9720 8.1790 -2.6630 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 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 25 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 46 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 M END