IBS-ZINC02269405 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 -0.1540 1.5530 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 0.0680 0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 -0.4100 0.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -0.6690 -0.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -2.1230 -0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 -2.6420 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2180 -2.2660 -1.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5060 -2.7260 -1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1890 -2.4380 -2.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5110 -2.8550 -2.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1800 -3.5670 -1.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4870 -3.8440 -0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1630 -3.4280 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6090 -4.0230 -1.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1670 -3.7390 -2.8880 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8130 2.0530 0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 1.7910 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 1.9180 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7300 -0.2040 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 -2.4610 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 -2.4930 0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 -3.7340 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 -2.2010 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6900 -1.8900 -3.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0250 -2.6250 -3.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9870 -4.3930 0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6810 -3.6700 0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1470 -4.6590 -0.8210 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 28 2 0 0 0 0 M CHG 1 15 -1 M END