MDPI-ZINC00337352 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 26 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 -1.8680 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 -2.7640 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -4.1380 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -4.9240 -0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -4.6160 -0.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1640 -3.7940 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9780 -2.4030 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0820 -1.5500 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3530 -2.0830 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5360 -3.4570 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4530 -4.3110 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1180 0.1090 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -2.4110 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9420 -0.4800 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2110 -1.4270 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5370 -3.8640 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6060 -5.3800 0.0180 H 0 0 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 18 1 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 2 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 14 25 1 0 0 0 0 M END