IBS-ZINC00536994 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 0.0160 1.4780 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -0.0100 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 -0.6170 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 -0.7990 0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -2.1760 0.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0620 -3.0300 0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3060 -2.5420 0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3670 -3.3930 0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2030 -4.7530 0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9540 -5.2570 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 -4.3770 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0410 -6.5900 -0.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2900 -7.0540 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7010 -8.3420 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1280 -8.6710 0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0940 -7.8410 -0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4310 -8.1570 -0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8180 -9.2910 0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8690 -10.1170 0.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5280 -9.8180 0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2550 -9.6220 0.4850 N 0 3 0 0 0 0 0 0 0 0 0 0 -11.0940 -8.8970 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.6000 -10.6190 1.0940 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.1210 -5.9060 0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3020 -5.9080 0.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 1.8720 0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 1.9580 -0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 1.6790 1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -1.6830 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -0.0520 -0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 -0.6980 1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 -0.4190 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4320 -1.4890 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3300 -3.0130 1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -4.7440 -0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9790 -9.1260 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7940 -6.9560 -0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1780 -7.5180 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1790 -11.0000 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7880 -10.4660 1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 25 2 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END