IBS-ZINC02209061 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 0.0400 1.5560 -0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 0.0410 -0.0430 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5310 -0.4650 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -0.2640 1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -0.3810 2.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 -0.4100 1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0690 -0.2800 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -0.4900 0.6830 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1810 -0.4540 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -0.7590 2.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0220 -0.7160 2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7530 -0.9620 3.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 -1.2380 4.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1220 -1.2730 4.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4180 -1.0340 2.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3670 0.0550 -0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7680 -0.4970 -0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8060 -2.0300 -0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 -2.5880 0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -2.0410 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2360 -2.5290 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4040 -4.0150 -0.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4940 -4.8790 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6300 -6.2550 0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6800 -6.7800 -1.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5960 -5.9310 -2.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4580 -4.5540 -1.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 1.9720 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3050 1.8300 -1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 2.0530 0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 -0.0540 -0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -0.9380 4.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6030 -1.4270 5.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9310 -1.4880 4.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4440 -1.0610 2.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 -0.1910 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3930 1.1400 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1380 -0.1360 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4430 -0.0930 -1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 -2.3540 -1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 -2.3430 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7400 -3.6810 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -2.4090 0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 -2.3220 -1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5260 -2.2570 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9520 -2.0160 -1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4560 -4.4870 1.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7010 -6.9190 1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7890 -7.8520 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6430 -6.3410 -3.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3970 -3.9040 -2.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -0.5220 0.0120 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7360 -0.2740 0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 52 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 52 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 1 0 0 0 0 18 21 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 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 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 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 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END