IBS-ZINC06756961 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.0600 -0.5960 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.6940 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -2.1590 0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2820 -2.5310 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 -2.7090 0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0300 -2.5990 1.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2410 -3.2280 2.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8380 -3.9660 1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2330 -4.0780 -0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 -3.4470 -0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 -3.4100 -1.5980 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 -2.6810 -1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -2.4790 -2.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 -4.0900 -2.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 -3.1480 -3.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7960 -3.9890 -5.2870 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.6310 -4.1970 -6.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7170 -5.0450 -5.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7260 -2.7990 -6.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0820 -1.9220 -7.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8120 -0.9880 -7.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1860 -0.9320 -7.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8300 -1.8100 -6.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1010 -2.7460 -6.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 -0.2200 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5610 -2.0220 2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7170 -3.1440 2.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7820 -4.4570 1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7050 -4.6560 -0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 -4.3730 -3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1430 -4.9830 -2.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2920 -2.8640 -3.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7910 -2.2540 -3.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0080 -1.9660 -7.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3080 -0.3020 -8.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7560 -0.2020 -8.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9040 -1.7660 -6.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6050 -3.4340 -5.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 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 26 43 1 0 0 0 0 M END