IBS-ZINC05350242 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 40 0 0 0 0 0 0 0 0999 V2000 0.2060 1.7340 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 0.3640 0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -0.3750 0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5350 0.2570 0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 1.6330 0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 2.3670 0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 -0.4900 0.1700 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8700 -0.0770 -0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7860 -1.1410 -0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1240 -2.1820 0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 -1.7880 0.6580 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0750 -0.9760 -0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3660 0.1740 -1.4500 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4730 1.1440 -1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2580 1.0360 -1.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0150 -1.9860 -0.7630 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2480 -1.8510 -1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3890 -2.4160 -0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6060 -2.2800 -1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6900 -1.5830 -2.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5560 -1.0190 -3.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3350 -1.1560 -2.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6510 -0.2740 -4.5120 N 0 3 0 0 0 0 0 0 0 0 0 0 11.7260 -0.1570 -5.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6520 0.2240 -5.0020 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7030 2.3110 0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -0.1270 0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -1.4450 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5560 2.1280 0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 3.4370 0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5490 -3.1410 0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7520 2.0620 -2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8190 -2.7880 -0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3250 -2.9600 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4940 -2.7190 -1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6430 -1.4780 -3.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4490 -0.7200 -3.0440 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 15 2 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END