MDPI-ZINC02005067 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 1 0 0 0 0 0999 V2000 0.3810 1.6660 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 0.1620 -0.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9860 -0.0190 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 -0.4140 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 0.0970 2.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 -0.3960 3.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9210 -1.4160 3.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 -1.9550 2.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 -1.4730 1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0360 -2.0840 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 -1.9600 -1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 -0.3250 -2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 -1.9140 4.7010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 0.0200 4.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 1.0660 5.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 1.8590 -0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 2.1060 -1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 2.2210 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 0.8850 2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0060 -2.7560 2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 -1.5860 -0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 -3.1470 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -2.3510 -2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -2.4750 -0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 0.7410 -2.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -0.8170 -2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -0.7800 -3.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -1.4060 5.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 1.9820 4.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 0.7580 4.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 1.2820 6.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -0.4990 -1.3190 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4140 -0.0270 -1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 14 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 11 32 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 12 32 1 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 32 33 1 0 0 0 0 M CHG 1 32 1 M END