IBS-ZINC02405829 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2040 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0340 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4290 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0930 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 -0.6850 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8780 -2.0280 -0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1930 -2.2670 -0.1180 N 0 3 0 0 0 0 0 0 0 0 0 0 5.8440 -1.1350 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9530 -0.1240 0.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6300 1.1750 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0940 0.9200 -0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2540 -0.5850 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8130 -3.5920 -0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0920 -4.1090 1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8020 -3.4370 2.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7150 -5.4280 1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9760 -5.9100 2.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5600 -7.1470 2.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8900 -7.9130 1.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6350 -7.4400 0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0460 -6.2080 0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4640 -9.1250 1.8740 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9870 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.1730 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 -2.7710 -0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1700 1.9050 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5860 1.5250 1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2370 1.1120 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7800 1.5190 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6590 -0.7270 1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8950 -1.0620 -0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1370 -4.2760 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7480 -3.5200 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7190 -5.3150 3.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7620 -7.5210 3.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8950 -8.0420 -0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8430 -5.8430 -0.7450 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 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 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 M CHG 1 9 1 M END