IBS-ZINC06661075 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2030 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.0350 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4340 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0960 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 -0.6780 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8520 0.0180 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0840 -0.6660 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2530 0.0360 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6200 -0.4910 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8610 -1.6840 -0.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5730 0.4260 -0.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2400 1.7220 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0060 2.6670 -0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4690 1.7980 -0.0670 S 0 0 0 0 0 0 0 0 0 0 0 0 10.9820 0.0270 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4530 -0.1040 -1.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6860 0.1160 -2.4410 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7250 -0.4640 -1.7860 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1820 -0.5910 -3.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6540 -1.0080 -3.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1250 -1.1380 -4.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6670 -0.0450 -5.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0990 -0.1620 -6.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9880 -1.3770 -7.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4440 -2.4720 -6.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0180 -2.3520 -5.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4120 -1.4950 -8.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -1.7610 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 1.9940 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 3.1760 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7090 -1.7580 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 1.0980 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1020 -1.7460 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5800 0.7810 0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0940 -0.9310 0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3380 -0.6390 -1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5850 -1.3450 -3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0710 0.3670 -3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2510 -0.2530 -2.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7660 -1.9660 -2.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7530 0.9010 -4.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5220 0.6920 -7.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3560 -3.4200 -7.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5990 -3.2060 -4.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3380 -1.7570 -8.6030 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 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 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 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 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 M END