IBS-ZINC05100825 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -0.0460 1.9270 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 0.4010 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -0.1180 1.2910 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7690 0.3720 1.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 -1.6300 1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 0.1760 2.5000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 0.2900 3.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 0.1490 3.7570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 0.5830 4.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 1.9150 5.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 1.6640 6.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6630 2.6820 7.3560 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 3.9340 6.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8500 5.0280 7.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 6.2960 7.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 6.5320 6.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 5.5000 5.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6270 4.1740 5.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 3.1500 5.0610 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 0.2950 6.7760 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 -0.3410 5.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 -1.7010 5.6000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 -0.3810 7.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 -0.7530 8.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 -2.0100 8.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 -2.3510 9.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -1.4360 10.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -0.1780 10.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 0.1690 9.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3100 1.4080 9.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 2.3050 10.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 2.3490 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 2.2960 -0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 2.2230 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 -0.0210 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 0.1050 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -2.1190 1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -1.8480 0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -1.9990 2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 0.2880 2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 4.8610 8.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9230 7.1320 7.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 7.5480 5.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 5.6980 4.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 -2.0840 4.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 -2.2810 6.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8130 0.2860 8.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5290 -1.2830 7.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 -2.7260 8.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -3.3340 9.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -1.7050 11.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 0.5360 11.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 1.8740 11.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 2.4680 10.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 3.2550 10.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 21 2 0 0 0 0 10 11 1 0 0 0 0 10 19 2 0 0 0 0 11 12 2 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 M END