IBS-ZINC05027058 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 -0.1140 2.2380 0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 0.8650 0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 0.0730 0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 0.6400 0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 2.0270 0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 2.8190 0.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3640 -0.2640 0.0990 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0590 -1.2400 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1410 -0.4730 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3550 0.3420 1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4910 0.7430 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4820 1.3330 -0.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 0.2960 -0.8370 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1270 0.3490 -2.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9240 -0.1190 -2.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 -0.0940 -4.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 0.3920 -5.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8930 0.8630 -4.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0990 0.8380 -3.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9590 1.3750 -5.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0500 1.7800 -4.9850 O 0 5 0 0 0 0 0 0 0 0 0 0 6.1350 0.6850 2.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8820 -1.2750 2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7270 -1.3730 3.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 -2.1270 2.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6210 -3.3140 1.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 -4.1230 1.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -3.7540 2.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -2.5760 3.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 -1.7660 3.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 2.8550 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 0.4090 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -0.9970 0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2490 2.5150 0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 3.8910 0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 -0.5170 -2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7570 -0.4590 -4.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 0.4020 -6.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0580 1.2060 -2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3670 -2.0340 4.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4480 -3.6200 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 -5.0440 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 -4.3850 2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -2.2880 4.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6590 -0.8460 3.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6850 1.3590 -6.7380 O 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 23 2 0 0 0 0 10 11 1 0 0 0 0 10 22 2 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 36 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 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 46 2 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 40 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 41 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 28 29 2 0 0 0 0 28 43 1 0 0 0 0 29 30 1 0 0 0 0 29 44 1 0 0 0 0 30 45 1 0 0 0 0 M CHG 1 21 -1 M END