MDPI-ZINC03847364 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -1.7570 1.0770 -0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 -0.2960 -0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.4140 -0.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -1.3910 -0.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3640 -1.2840 -0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -1.8170 -2.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 -3.1360 -2.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4510 -3.9480 -3.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8600 -5.1680 -3.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7680 -5.5870 -2.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -4.7790 -1.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 -3.5560 -1.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 -2.7380 -0.4770 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5780 -3.2220 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -2.6400 -0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -1.9330 -1.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -0.7950 -1.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 -0.1440 -3.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -0.6340 -4.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 -1.7760 -4.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -2.4260 -3.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 0.0050 -5.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -6.7830 -3.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -7.1450 -2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3420 -5.9540 -4.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4640 -5.4580 -5.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 1.8320 -0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 1.1970 -1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5590 1.1940 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9010 -1.8790 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6730 -0.2410 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7310 -1.9500 -2.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3020 -1.0960 -2.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2970 -3.6220 -3.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 -5.1010 -1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -2.0810 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -3.6420 -0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 -0.4140 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 0.7450 -3.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -2.1590 -5.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -3.3180 -3.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 -0.3080 -5.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -6.3990 -2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 -7.1930 -1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -8.1190 -2.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3020 -5.3020 -4.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2000 -4.5130 -5.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7480 -6.1810 -6.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M END