MDPI-ZINC03845742 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 29 0 0 1 0 0 0 0 0999 V2000 -2.1490 1.4680 -1.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 -0.0280 -1.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 -0.4220 -2.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 -0.3530 0.0520 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3040 0.2590 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8190 -1.8370 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -2.1300 1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -3.6150 1.6840 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6200 -4.2150 1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -4.1080 0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -3.9060 3.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8330 -3.0810 3.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 0.0230 1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3160 -0.6450 1.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5530 1.6930 -2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9030 1.7810 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 2.0820 -1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7600 -0.5850 -1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 0.0080 -2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 -1.5080 -2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -0.0690 -3.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 -2.4750 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 -2.1260 -0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -1.5120 1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6840 -1.8300 2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6440 -5.1220 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -4.1400 -0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 -3.4590 0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -4.9670 3.6090 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.8990 0.9850 1.8830 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 18 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 13 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 11 29 1 0 0 0 0 13 14 2 0 0 0 0 13 30 1 0 0 0 0 M CHG 1 29 -1 M CHG 1 30 -1 M END