MDPI-ZINC03843336 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 30 0 0 1 0 0 0 0 0999 V2000 -0.0900 1.4270 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 0.3300 0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -0.4820 -0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 0.4260 -1.1540 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1210 0.9420 -0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 1.4930 -1.9080 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3340 2.1830 -2.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 2.3110 -0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 0.9520 -3.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -0.1260 -3.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4090 -0.3130 -2.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2980 0.2540 -2.7150 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 -1.6480 -2.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7550 -2.4040 -3.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 -2.7720 -4.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 -1.6470 -4.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8010 -1.0020 -4.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 0.9720 -0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 2.0450 0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 0.7830 1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -0.3350 1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -1.2000 0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -1.0740 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 3.0710 -1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 2.8620 -0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5780 -1.8640 -3.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1610 -3.3130 -2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0580 -3.5350 -4.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 -3.1590 -3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 1.6520 -3.3830 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 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 20 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 M CHG 1 30 -1 M END