IBS-ZINC04812944 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 41 0 0 0 0 0 0 0 0999 V2000 -0.1930 0.7990 0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3070 1.1690 2.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 3.0630 1.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 3.4830 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 5.0070 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6630 5.4010 -1.0840 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 6.6940 -1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7360 7.1210 -2.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3210 6.1560 -3.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1830 4.9380 -3.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0470 6.7240 -4.4190 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2840 8.0570 -4.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 8.3950 -5.6120 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7210 8.9430 -3.7340 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9450 8.5760 -2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 9.3860 -1.8470 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9580 10.3670 -3.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2550 10.7560 -3.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3500 11.5330 -2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 -0.2670 0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 1.1450 0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 0.9750 -0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 1.4770 2.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4030 0.0850 2.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 1.6720 3.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 3.3680 1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 3.5020 2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3550 3.0900 -0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7570 3.0630 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2630 5.4110 0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 5.4300 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0540 4.6820 -1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5560 7.4140 -0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4620 6.0880 -5.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1230 10.9550 -3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0200 10.5820 -5.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1670 10.3920 -3.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4690 11.9230 -1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3200 11.7900 -1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 1.5570 1.4940 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8610 1.2580 1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 40 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 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 15 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 40 1 M END