MDPI-ZINC02011467 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 1 0 0 0 0 0999 V2000 0.7710 -0.4180 1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -0.1120 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -0.6260 -0.0190 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9340 -0.1660 0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 -0.3030 -1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0560 1.2060 -1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 1.5390 -2.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2600 1.0240 -2.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2690 -0.4800 -2.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 -0.8260 -1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8480 1.3260 -4.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2660 1.2470 -4.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 -2.1590 0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -2.8250 -0.6860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7590 0.0530 1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -0.0280 2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -1.4930 1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 0.9760 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -0.5280 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -0.8130 -2.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 1.7620 -0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 1.5660 -1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8240 2.6240 -3.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 1.1160 -3.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8040 1.5580 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2980 -0.8460 -2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8290 -1.0160 -3.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5320 -1.9150 -1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0570 -0.4060 -0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6030 0.2170 -4.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6930 1.8970 -3.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6230 1.5880 -5.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 -2.5590 1.2150 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 13 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 M CHG 1 33 -1 M END