MDPI-ZINC03844061 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7710 -0.5250 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 -0.2500 0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 -0.1800 -0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2310 0.0920 -1.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -0.5190 -1.1590 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3790 0.1540 -2.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 -0.4710 -2.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -0.7390 -1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 -0.5320 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 -0.8420 0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4400 -1.3090 0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9670 -1.4760 -0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 -1.2210 -1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6330 -1.4000 -2.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8990 -1.8680 -3.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7060 -2.1760 -2.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2770 -1.9430 -0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9650 -2.6440 -2.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -2.0360 -1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 0.0330 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -1.5920 1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 0.6980 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8870 -1.0600 1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 1.2250 -2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -0.0220 -3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 0.2040 -3.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 -1.4120 -3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -0.7070 1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0350 -1.5490 1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 -1.1660 -3.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2860 -2.0040 -4.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9000 -2.1850 0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0220 -3.6070 -2.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 -2.2850 -1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 -2.3920 -2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 -2.5120 -0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 11 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 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 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 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 21 40 1 0 0 0 0 21 41 1 0 0 0 0 M END