IBS-ZINC02297829 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 0 0 0 0 0 0999 V2000 -0.4820 0.1910 -0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 0.7150 0.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 -0.0370 1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 0.4160 2.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -0.3420 3.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8730 -1.5720 3.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 -2.0230 1.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 -1.2590 0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 -2.3850 4.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2070 -1.8080 5.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8410 -2.6420 6.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3360 -2.1240 7.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8740 -3.9820 6.0780 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5060 -4.8140 7.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4100 -6.2640 6.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8690 -6.5710 5.6700 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 -0.4170 5.3420 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 0.1320 6.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 -0.5790 7.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 1.5990 6.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 2.1710 7.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 3.5410 7.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1870 4.3470 6.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7460 3.7860 5.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 2.4180 5.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -0.7680 -0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 0.8880 -1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 0.0510 -1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 1.3650 2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4990 0.0110 4.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 -2.9710 1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 -1.6090 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7780 -3.4430 3.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4800 -4.3950 5.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5550 -4.5340 7.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9980 -4.6650 8.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5490 0.1520 4.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 1.5430 8.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 3.9850 8.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 5.4190 6.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 4.4210 4.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 1.9820 4.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9260 -7.2150 7.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8390 -8.1310 7.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 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 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 17 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 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 43 1 0 0 0 0 17 18 1 0 0 0 0 17 37 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 25 2 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 43 44 1 0 0 0 0 M END