MDPI-ZINC03848020 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 39 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2030 -0.6920 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 0.0140 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 1.4260 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 2.1000 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6580 2.1630 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6940 3.3340 0.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9230 1.4340 -0.4150 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9590 1.2940 -1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1280 2.2440 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4050 1.4450 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4230 0.1500 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7290 -0.6080 -0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8110 0.2360 -0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7920 1.5330 -0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6880 2.2460 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1690 -0.6910 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9530 0.0740 0.3070 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0290 0.2150 1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 -0.6880 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7540 -1.8600 -0.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9020 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5520 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -1.7720 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 3.1800 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2150 3.1450 -0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9790 2.5290 1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0320 -0.9250 0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5820 -1.4900 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6260 -0.2410 -1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5920 2.1080 -1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5130 3.2070 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9870 2.4200 0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9790 -0.9910 -1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3150 -1.5830 0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 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 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 19 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 M END