IFLAB-ZINC04270458 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 1 0 0 0 0 0999 V2000 0.1590 1.7510 -0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 0.2340 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 -0.2140 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -0.3690 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1960 -0.7800 1.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 -1.0370 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3950 -0.8830 -0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 -0.4660 -1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 -0.3050 -2.3880 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 0.2570 -3.6420 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 0.4440 -4.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5830 -0.5790 -3.7000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0100 1.8600 -3.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 2.9760 -3.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6990 4.2230 -3.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9120 4.3400 -2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6670 3.2380 -2.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2160 1.9870 -2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8780 3.7840 -1.4380 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.9200 3.4010 -0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6660 5.2890 -1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4100 6.1150 -0.9470 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5120 5.5360 -2.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8440 6.8180 -2.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9830 6.6500 -3.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9720 5.5100 -3.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1570 3.4230 -2.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 2.0750 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 2.0180 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 2.2410 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -0.2560 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -0.0330 0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -0.1690 2.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6340 -0.9000 2.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9780 -1.3580 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9850 -1.0840 -1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -0.5220 -2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 2.8620 -4.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7960 1.1100 -2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5920 7.5930 -2.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2110 7.0940 -1.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6340 6.4420 -4.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4450 7.5800 -3.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 5.7320 -2.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 5.4080 -4.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2450 2.3390 -2.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0190 3.8240 -1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1170 3.8500 -3.1980 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 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 16 17 2 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 27 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 M END