IBS-ZINC00501050 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 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 0.2510 -2.6710 0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -4.0390 0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 -4.5780 1.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -3.7300 2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 -2.3450 2.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 -4.5270 3.4930 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9680 -5.7760 3.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 -5.8670 2.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -7.1030 1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 -6.9510 3.9740 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 -0.2610 -2.2540 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -4.6900 -0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8930 -1.6840 3.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6840 -7.3940 0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -7.8950 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -6.9380 0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 -7.2490 4.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 -7.7840 3.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 -6.6690 4.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 19 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 20 1 0 0 0 0 6 7 1 0 0 0 0 6 21 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 22 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 13 23 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 M END