IBS-ZINC05157015 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 48 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 5.7200 -0.4800 4.4600 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6150 0.2600 5.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0860 1.3210 4.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9290 -0.4920 6.4470 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1530 0.1630 7.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0840 -1.4310 6.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0310 -2.7330 6.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9860 -3.2100 7.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6820 -2.4800 7.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6060 -1.2590 6.6060 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8860 -0.5660 7.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1710 -1.4800 5.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4700 -2.3780 4.7730 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 6.0450 2.3420 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0580 -1.6230 5.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0240 -0.9350 6.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9360 -3.3230 6.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0550 -4.1860 7.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8820 -3.1650 7.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5190 -2.1660 8.5060 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 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 34 1 0 0 0 0 6 35 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 36 1 0 0 0 0 9 37 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 38 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 29 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 23 1 0 0 0 0 21 27 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 M END