IBS-ZINC00286270 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 0 0 0 0 0 0999 V2000 -0.2140 1.8020 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 0.4370 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -0.3410 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1090 0.2690 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 1.6350 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 2.4060 -0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 3.8580 -0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 4.3130 -1.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 4.5360 -0.1300 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 5.8650 -0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4980 6.3970 0.2410 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5750 7.7340 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 8.1980 -0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 6.9160 -1.2620 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -1.7210 0.5690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -2.5300 0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -2.1750 0.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 -3.9640 1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 -4.9010 1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 -6.3220 1.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 -7.3590 2.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6330 -6.9470 2.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 2.3870 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 0.0110 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0280 -0.3130 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 2.0620 -0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 4.0620 0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3970 8.3300 0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 9.1930 -1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 -2.1660 0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -4.3180 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -3.9580 1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 -4.5380 2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -4.8950 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -6.6760 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 -6.3180 2.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 -8.5250 2.2480 O 0 5 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 28 1 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 30 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 M CHG 1 37 -1 M END