IBS-ZINC02149180 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 -0.8770 1.3270 0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -0.3980 0.3130 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.9830 -1.1990 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9240 -2.7310 0.2340 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4370 -3.0780 1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4330 -3.1060 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8930 -3.4670 -0.8720 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 -3.3410 -0.9310 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 -3.4530 -1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -3.7690 -0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -3.7080 -0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -4.3920 -2.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 -5.9110 -2.1300 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2120 -6.1050 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -6.5340 -3.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 -7.2480 -3.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0370 -7.8350 -4.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 -7.7190 -5.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -7.0220 -5.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -6.4340 -4.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -6.5560 -1.8660 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 -6.1020 -2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 -7.7530 -1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -8.3330 -0.6820 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 -8.3310 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 -9.0790 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6890 -9.6500 0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6700 -9.4830 -0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3920 -8.7530 -1.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1310 -8.1790 -2.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 1.9790 0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 1.5120 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 1.5690 1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6100 -0.7970 0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4170 -0.8820 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -4.1390 -3.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 -3.9370 -2.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8850 -7.3600 -2.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9640 -8.3870 -4.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9290 -8.1770 -6.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -6.9400 -6.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 -5.9050 -4.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6670 -9.2100 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9040 -10.2220 1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6530 -9.9260 -0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1570 -8.6330 -2.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 -7.6390 -2.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 -3.0010 1.3720 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 48 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 45 1 0 0 0 0 29 30 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 M CHG 1 48 -1 M END