IBS-ZINC02210058 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.2960 1.7700 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 0.4290 0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -0.1700 0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 0.5710 0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 1.9300 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 2.5220 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3190 2.7280 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4080 2.1870 -0.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 4.0570 -0.3540 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3700 4.7980 -0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3800 4.2220 -1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5070 4.9550 -1.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6310 6.2620 -1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6240 6.8380 -0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4920 6.1110 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7340 6.9770 -1.6200 F 0 0 0 0 0 0 0 0 0 0 0 0 3.4470 -0.0310 0.5340 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 -1.3520 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -2.0000 -0.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 -2.0130 0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9700 -1.2720 1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1800 -1.8960 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3170 -3.2530 1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2440 -3.9930 0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0270 -3.3820 0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 -5.4430 0.2970 N 0 3 0 0 0 0 0 0 0 0 0 0 7.4720 -5.9840 0.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4560 -6.0960 -0.1110 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.2690 2.2280 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 -0.1520 0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 -1.2160 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 3.5670 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 4.5010 -0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2850 3.2020 -1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2940 4.5080 -2.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7220 7.8570 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 6.5620 0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2190 0.5010 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8640 -0.2130 1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0210 -1.3240 1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2660 -3.7360 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 -3.9620 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 42 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END