IBS-ZINC00550269 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3830 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 1.1970 -0.6890 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 0.0110 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 1.4150 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7850 1.8530 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5630 0.6890 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -0.4050 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0090 -1.3310 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9570 0.8300 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4750 2.0530 -0.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7020 3.1240 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3890 3.0410 -0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7800 -0.2860 -0.0600 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1960 0.1040 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0690 -1.1420 -0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7900 -2.1100 0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3000 -2.4600 0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4820 -1.1730 1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5630 -3.3030 0.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4110 -3.4350 1.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6860 -2.5730 2.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1580 -1.4920 2.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9080 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5520 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -1.7690 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 3.1730 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1640 4.1000 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3780 0.7880 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4430 0.5990 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8350 -1.6270 -1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1200 -0.8540 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0300 -2.9720 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0940 -3.1100 1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7390 -0.6720 2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4190 -1.4170 1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4670 -4.4750 2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4060 -3.0390 1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8820 -3.1340 3.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3900 -2.1970 3.7090 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 14 2 0 0 0 0 8 9 1 0 0 0 0 8 11 2 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 M END