IBS-ZINC02211085 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 -1.0730 0.1110 -3.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 -1.0120 -2.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7230 -1.3060 -1.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 -0.6420 -1.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -2.4330 -0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -3.2200 -1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 -4.2720 -0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 -4.5560 0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 -3.7880 0.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4540 -2.7200 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6010 -1.9410 0.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7960 -2.5280 0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8590 -3.7280 0.6110 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0270 -1.7140 0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2660 -2.3230 0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4100 -1.5670 0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3360 -0.1880 0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0990 0.4210 0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9540 -0.3340 0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5710 0.6280 0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7920 1.5860 1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0450 2.3400 1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2340 3.5010 2.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4120 4.1890 2.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4210 3.7450 1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2550 2.6020 0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0680 1.8860 0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8900 0.7580 -0.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.6130 0.4540 -0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3320 0.0450 -1.6810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 0.2390 -4.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 -0.0790 -4.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 1.0170 -3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 -3.0040 -1.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -4.8790 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 -5.3830 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9700 -4.0160 1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5400 -0.9750 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3230 -3.3890 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3670 -2.0370 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0430 1.4870 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9960 0.1380 0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0730 1.7730 2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4540 3.8530 2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5580 5.0840 2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3450 4.2990 1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0470 2.2650 -0.2490 H 0 0 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 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 38 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 19 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 29 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 M END