MDPI-ZINC00382847 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 30 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7000 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -2.0810 1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -2.7730 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0770 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 -2.7370 -2.4420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -3.8320 -2.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 -4.2480 -3.9210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 -4.5860 -1.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -5.1310 -2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5260 -5.8700 -1.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1730 -6.0520 -0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 -5.5190 0.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -4.7830 -0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -4.1710 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -0.1630 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -2.6240 2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1370 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 -2.3530 -3.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9520 -4.9780 -3.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4380 -6.3010 -2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 -6.6430 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 -4.7050 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 24 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 26 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 28 1 0 0 0 0 M END