MDPI-ZINC03845867 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 40 0 0 1 0 0 0 0 0999 V2000 -0.3910 -0.2740 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -1.6770 0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -1.6440 -0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -3.0580 -1.2310 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1780 -3.6300 -1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -3.0830 -2.7170 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5100 -4.5600 -3.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -4.7940 -4.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 -3.9370 -3.6650 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6790 -4.0670 -4.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 -2.4550 -3.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 -2.2200 -2.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2080 -1.8810 -4.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6810 -1.6140 -3.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4620 -4.5010 -2.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8050 -4.2260 -1.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -2.4640 -3.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 -3.7080 -0.3310 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 -3.8250 -0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 0.3210 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 0.2440 0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -0.3190 2.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -2.1750 1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -2.2530 0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -1.0920 -1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -1.0880 -0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 -5.1960 -2.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -4.9730 -3.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9640 -5.8590 -4.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 -4.5810 -5.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 -2.4260 -5.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8650 -0.8430 -4.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0930 -1.9060 -5.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6010 -1.7570 -3.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4300 -0.5460 -3.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8840 -1.8530 -1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 -1.3740 -3.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -2.6710 -4.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 -2.8710 -3.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5160 -5.1870 -2.4680 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 18 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 M CHG 1 40 -1 M END