MDPI-ZINC03844250 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -0.4530 0.4200 0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 -0.9260 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -1.3330 0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1860 -0.3940 0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8740 0.9520 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 1.3580 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 -0.8370 0.0820 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6730 -1.9240 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2410 -0.3690 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5410 -1.0690 -2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2270 -0.6820 -3.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5730 -1.3360 -4.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4010 -0.2290 1.2520 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4370 0.8550 1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8040 -0.7790 1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8460 -0.0260 0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1330 -0.5310 0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3770 -1.7890 1.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3350 -2.5420 1.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0490 -2.0350 1.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7490 -0.5590 2.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4850 0.7370 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -1.6600 0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 -2.3840 0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6610 1.6850 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 2.4100 0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1180 0.7100 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3030 -0.6160 -1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 -2.1490 -2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 -0.7630 -2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1680 0.3980 -3.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2720 -0.9880 -3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9560 -1.1360 -5.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6560 0.9570 0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9480 0.0570 0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3830 -2.1840 1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5260 -3.5250 2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2350 -2.6220 2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6810 -1.5100 2.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 M END