IBS-ZINC05423641 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.5920 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 4.0610 1.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 5.4060 1.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 6.2510 0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 7.6220 0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 8.1480 1.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 7.2930 3.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 5.9200 2.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 7.7860 4.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 9.0740 4.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 9.4660 5.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 10.7820 6.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 11.7320 5.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7470 11.3650 3.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 10.0360 3.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 9.6030 2.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 10.4010 1.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4280 13.3850 5.4780 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 8.4520 -0.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -2.1590 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1820 -2.7820 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -2.7540 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -0.4990 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 3.9710 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 3.9460 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 5.8380 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 5.2500 3.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 8.7380 6.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 11.0780 7.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 12.1030 3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 8.6830 -0.7490 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 26 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 25 40 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