OTAVA-ZINC04158452 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 34 0 0 1 0 0 0 0 0999 V2000 0.1240 0.7790 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -0.9990 0.2280 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -1.3350 -1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -2.8210 -1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 -3.1410 -2.8690 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4650 -2.7390 -3.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 -4.6790 -3.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 -5.3490 -2.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4680 -2.5140 -2.9520 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9930 -1.8680 -4.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4540 -2.0460 -5.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9380 -1.3480 -6.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9890 -0.4350 -6.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5430 -0.2290 -5.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0490 -0.9390 -3.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6530 -0.6500 -2.6430 N 0 3 0 0 0 0 0 0 0 0 0 0 5.6980 -1.5610 -1.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0950 0.4950 -2.4630 O 0 5 0 0 0 0 0 0 0 0 0 0 5.4840 0.3450 -7.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2780 -0.2860 -8.7040 F 0 0 0 0 0 0 0 0 0 0 0 0 4.8780 1.5600 -7.6270 F 0 0 0 0 0 0 0 0 0 0 0 0 6.8220 0.6030 -7.4610 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 1.2950 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 0.9750 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 1.1700 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -1.0410 -2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 -0.7210 -1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 -3.1050 -0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -3.4220 -1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0640 -2.6000 -2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 -2.7630 -5.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4820 -1.5320 -7.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3550 0.4880 -4.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 -5.0880 -4.2190 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 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M CHG 1 34 -1 M END