IBS-ZINC05155969 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 40 0 0 0 0 0 0 0 0999 V2000 0.7130 1.7950 0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 0.2910 0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 -0.2060 -1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -1.7210 -1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 -2.1970 -2.4990 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7980 -2.5730 -2.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5490 -2.5010 -1.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2750 -3.0640 -3.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5530 -3.4520 -3.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2230 -3.9380 -5.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6190 -4.3420 -5.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0120 -4.8310 -6.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2260 -4.8670 -7.4380 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3290 -5.2220 -6.5700 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9790 -5.7330 -7.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4650 -6.0820 -7.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8460 -5.8650 -6.3330 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 -3.1230 -5.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 -3.5190 -6.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 -2.6900 -4.7640 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -2.2280 -3.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 -1.8660 -3.5370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 2.0780 0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 2.3290 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 2.1280 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -0.2120 1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 0.0380 0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 0.3040 -1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1590 0.0550 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 -2.2340 -0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -1.9830 -1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2090 -3.4020 -3.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6890 -4.0250 -5.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2620 -3.4950 -4.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7950 -5.1550 -4.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9700 -5.1860 -5.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4340 -6.6250 -8.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8990 -4.9670 -8.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -2.7130 -5.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1020 -6.5310 -8.5180 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 M CHG 1 40 -1 M END