IBS-ZINC00540859 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.8250 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -2.6740 0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 -4.0400 0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -4.5860 1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -3.7310 2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 -2.3480 2.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 -4.5950 3.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 -5.9150 3.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 -5.8920 1.9660 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 -6.6780 1.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 -6.9480 3.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1100 -6.6310 5.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 -5.3720 5.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8510 -4.3690 4.7000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 -8.2750 3.6070 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7920 -9.3440 4.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 -10.6820 3.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3320 -11.2790 2.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0240 -12.5060 2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 -13.1370 2.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 -12.5400 3.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -11.3150 4.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.2570 -0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -4.6900 -0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 -1.6890 3.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 -5.1580 6.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 -8.4960 2.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8750 -9.2450 4.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 -9.2700 5.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2580 -10.7860 2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 -12.9720 1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 -14.0950 2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -13.0330 3.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -10.8510 4.8880 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 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 17 2 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 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 M END