IBS-ZINC02353493 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 44 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5290 -1.7820 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5030 -0.3170 -1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1120 1.0500 -1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1860 1.7710 -2.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5780 1.4940 0.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3650 0.6950 1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 -0.3450 1.1460 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5190 -0.9230 2.4130 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3840 -0.2330 3.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8970 0.7520 2.3540 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7190 -0.4800 4.4600 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6080 0.2410 5.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2370 1.1940 4.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6900 -0.3210 6.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4170 -0.0020 7.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2550 -0.7540 8.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3740 -1.8190 8.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6410 -2.1510 7.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7920 -1.4080 6.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1900 -1.4650 5.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3590 -2.2690 4.8360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2970 -1.0460 -1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8350 -0.3200 -2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0440 2.3420 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1070 0.8290 7.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8210 -0.5070 9.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2570 -2.3980 9.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9540 -2.9840 7.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 17 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 M END