MDPI-ZINC04268109 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 -1.9800 0.6090 0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 0.0060 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 0.0650 0.7930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 0.6550 2.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 1.9450 2.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 2.5320 3.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 1.8250 4.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 0.5180 4.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.0580 3.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 -0.2500 5.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -1.4440 5.4510 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7110 -0.7030 -1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -0.3980 -2.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -1.0350 -3.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 -0.7510 -4.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 -1.3900 -5.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -2.3130 -5.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 -2.6010 -4.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 -1.9580 -3.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7230 -2.2730 -2.7580 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7690 -1.6820 -1.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6520 -1.9730 -0.6930 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8170 1.6280 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7140 0.6670 -0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 -0.0060 1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 2.4940 1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 3.5390 3.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 2.2910 5.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -1.0730 3.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 0.3210 -1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 -0.0370 -4.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 -1.1680 -6.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -2.8070 -6.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -3.3180 -5.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 0.3580 6.7680 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 12 1 0 0 0 0 3 4 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 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 35 2 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 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 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 M CHG 1 11 -1 M END