IBS-ZINC00543250 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.6990 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0790 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7730 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0660 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.2540 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.8900 -1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -6.3900 -1.3070 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8300 -6.6880 -2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -6.9870 -0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -6.2960 1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -7.1250 2.1190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -8.3440 1.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -8.3020 0.3110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -4.9390 1.2000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -6.8660 -1.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 -7.5670 -2.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 -8.0040 -3.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7600 -7.7390 -2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 -7.0390 -1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4050 -6.6060 -1.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0870 -8.2060 -3.0880 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.1880 -8.8230 -4.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0790 -7.9730 -2.4200 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.1610 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6210 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.5980 -2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1380 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -4.3020 -2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -9.2220 2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -4.4850 2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 -7.7730 -3.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 -8.5510 -4.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5250 -6.8320 -0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 -6.0620 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END