MDPI-ZINC03846087 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 0 0 1 0 0 0 0 0999 V2000 -0.0080 1.4980 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -0.0320 0.0180 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0100 -0.4090 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -0.5650 1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -2.0950 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4880 -2.5610 -0.0770 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5110 -2.1830 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -2.0270 -1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1320 0.0240 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 0.3130 -0.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.1850 -2.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 0.0010 -2.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5090 -4.0900 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 -4.5560 -1.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 -4.6240 1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 1.8750 0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 1.8780 -0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 1.8300 0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 -0.1880 1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 -0.2340 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -2.4750 2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -2.4720 1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -2.3590 -2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4040 -1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 1.1850 -2.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 0.0440 -2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 -0.5570 -3.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -0.2560 -3.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -4.4670 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2370 -4.1780 -1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 -5.6450 -1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 -4.1760 -2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 -4.2920 2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 -5.7130 1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 -4.2460 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 30 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 M END