MDPI-ZINC04701290 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 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 0 0 0 0 0 0 0 0 0 0 0.7170 -0.5920 1.2690 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7740 -0.3490 1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 -0.0700 2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -0.0800 1.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -0.6150 0.3200 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0230 -2.1140 0.5180 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0010 -2.6300 -0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 -2.0830 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 -3.1010 1.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -4.5080 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 -5.2710 0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6620 -4.7280 0.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 -2.7520 1.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -0.3190 -0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -0.5560 -1.2980 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 -0.1870 -0.7370 3.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 0.9420 2.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2940 -0.7480 2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 0.9280 1.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 -2.9320 1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -5.0020 2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -4.4800 0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7550 -3.6860 1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 -0.7100 -1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4460 -0.7940 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6720 0.7590 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 -0.1890 -1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 -1.6450 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.2270 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 -6.5540 0.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 -7.0010 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 15 28 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 35 36 1 0 0 0 0 M END