IBS-ZINC00408889 MOE2007 3D Structure written by MMmdl. 40 42 0 0 0 0 0 0 0 0999 V2000 3.5460 4.3770 13.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3930 2.8590 13.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8470 2.3370 11.9140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 1.0030 11.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9300 0.3040 12.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 0.4170 10.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 -0.9260 10.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 -1.0600 9.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 0.2020 8.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7570 1.0780 9.5580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 0.5350 7.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 1.3020 7.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 1.6240 5.9290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 1.2270 4.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 1.5980 3.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 1.1820 2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 0.3890 2.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 0.0200 3.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 0.4310 4.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5090 0.0460 6.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -0.6430 6.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 1.5470 1.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 1.8030 8.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2140 4.6090 12.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 4.8270 12.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9620 4.7750 13.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7240 2.6260 13.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 2.4090 13.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 -1.7200 11.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -1.9790 8.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 2.2100 3.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 0.0680 1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 -0.5920 3.6270 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 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 2.3950 8.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 0.9550 8.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 2.4220 8.9500 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 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 M END