IBS-ZINC00550800 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 -0.5530 1.0910 2.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -0.3240 2.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 -0.8200 1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3430 0.0440 0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2740 -0.4470 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3530 -1.8090 -0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4810 -2.6900 0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -2.1800 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5560 -4.1300 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -4.8710 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -4.2170 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 -3.6980 -0.0950 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 -6.3340 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5550 -6.8900 -0.2530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -7.0600 -0.3500 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 -8.4340 -0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -9.1580 -0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -10.5220 -1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 -11.1180 -0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 -10.3380 -0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -9.0400 -0.5520 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2680 -2.2900 -1.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 1.3530 3.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 1.5860 1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 1.4150 2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 1.1060 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9430 0.2320 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -2.8480 1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5170 -4.6110 -0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 -6.6240 -0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -8.6620 -0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 -11.1100 -1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 -12.1810 -1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 -10.7970 -0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9490 -2.3440 -2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 3 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 20 2 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 22 35 1 0 0 0 0 M END