MDPI-ZINC04292903 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -1.5490 2.5050 2.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2490 1.0320 1.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 0.6280 2.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3160 0.0880 1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 -1.1950 1.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0040 -2.2670 1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4380 -1.7560 1.3500 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5650 -0.4020 0.6380 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6040 -0.0740 0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6960 0.6290 1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1310 -0.5670 -0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0710 -1.5590 -1.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0190 -2.9120 -0.7940 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0010 -3.2980 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3950 -2.7450 0.6780 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3370 -3.7100 1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8270 -2.2050 0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7660 -3.2600 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4370 -3.5410 -1.3030 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.9480 -3.8890 -1.4790 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7080 -3.9360 -2.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8510 -5.3090 -0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1640 -5.9720 -1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1410 -4.8500 -1.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2620 -4.9680 -2.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8560 -2.3800 -2.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7590 -1.6040 2.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 3.0460 2.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9280 2.8620 1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2990 2.6740 2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 -1.4900 1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8610 -2.5710 0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8430 -3.1260 1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1470 0.8820 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6310 1.5280 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1810 0.3960 -1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1100 -0.9480 -0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0900 -1.1720 -1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7660 -1.6850 -2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0960 -2.0060 1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9020 -1.2870 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6650 -4.1820 0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7930 -2.9040 0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9850 -5.8360 -1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8110 -5.2730 0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9810 -6.5530 -2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5630 -6.6170 -0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5910 -1.4360 -1.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3420 -2.4610 -3.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9330 -2.4150 -2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0660 -0.8930 3.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7800 -1.2400 2.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 -2.5700 3.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 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 15 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 M END