MDPI-ZINC01719170 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 -0.4040 0.9140 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 0.9280 2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 1.3760 3.7360 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1640 0.9250 3.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 2.8780 3.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 3.5020 4.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 4.8780 4.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 5.6370 3.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 5.0090 2.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 3.6290 2.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 2.9960 1.3170 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4590 3.1410 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 3.6610 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8380 3.4610 0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6050 4.4470 0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9670 4.2640 1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5610 3.0940 0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7940 2.1090 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4330 2.2940 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 6.9890 3.8610 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 5.4850 6.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 4.6410 7.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 0.9580 4.9350 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -0.1580 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 1.0890 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 1.3310 -0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 1.2370 2.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -0.1570 2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8970 2.9110 5.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 5.5970 1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 4.7270 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 3.2120 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1410 5.3600 1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5660 5.0340 1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6240 2.9510 0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2580 1.1950 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 1.5260 -0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 7.4590 4.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 4.0920 7.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7650 5.2510 8.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2630 3.9370 7.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 1.2080 5.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 1.5600 1.3220 N 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 23 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 2 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 43 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 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 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 M END