MDPI-ZINC03846548 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6830 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 0.0190 2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -0.6660 3.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -2.0540 3.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.7640 2.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0880 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.8340 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.1130 -1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6530 -1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.0140 -2.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.8130 -2.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -2.2520 -3.6860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -3.1880 -4.7460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 -4.4660 -4.2020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4540 -4.6200 -4.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -4.3170 -2.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 -5.5860 -4.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 -5.3340 -5.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3000 -6.3610 -6.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -7.6430 -6.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -7.9000 -5.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -6.8720 -4.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 -7.1240 -4.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -4.1850 -0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 1.0990 2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -0.1180 4.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -2.5760 4.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -3.8430 2.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -4.7120 -2.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -4.8050 -2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0080 -4.3340 -5.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2520 -6.1620 -6.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 -8.4440 -6.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -8.9020 -5.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0940 -7.0280 -4.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -4.5830 0.8400 H 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 1 0 0 0 0 2 11 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 25 40 1 0 0 0 0 26 41 1 0 0 0 0 M END