IBS-ZINC02289978 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 29 0 0 0 0 0 0 0 0999 V2000 -0.0390 1.2150 0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.1740 0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -0.8540 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 -0.0970 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 1.2980 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 1.9610 0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7090 1.7480 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3080 3.0260 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6820 3.1270 -0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4640 1.9910 -0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8900 0.7180 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5110 0.6180 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 -0.4880 -0.1170 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1490 -1.8680 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1020 -2.4260 -1.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1470 -2.2430 -2.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5670 5.0120 -0.4570 I 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 1.7250 0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.7420 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -1.9370 0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 3.0450 0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6940 3.9120 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5300 2.0720 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4970 -0.1690 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1650 -1.9050 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 -2.4520 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0440 -3.0500 -1.8460 O 0 5 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 18 1 0 0 0 0 2 3 2 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 21 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 22 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 15 27 1 0 0 0 0 M CHG 1 27 -1 M END