IBS-ZINC04029562 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 34 0 0 1 0 0 0 0 0999 V2000 0.0560 1.4720 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 0.0770 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 -0.6770 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -2.0650 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8280 -2.1880 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3640 -0.9340 0.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3400 -0.6470 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 0.0030 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 1.3990 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 2.1180 -0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8520 2.0560 -0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8590 1.2780 -0.0730 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5990 -3.4710 0.2000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0450 -3.6860 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6230 -4.6190 0.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -4.5480 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -3.2440 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7190 -3.3540 1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6450 -3.7610 2.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8600 -2.7470 0.7710 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6330 -2.6280 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9710 -2.4060 -0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 2.0600 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -0.4130 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 3.2030 -0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1170 -5.5820 0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 -4.5940 1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 -4.6210 -1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -5.4060 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -3.3000 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -3.1320 -0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8890 3.3230 -0.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 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 8 1 0 0 0 0 4 5 2 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 32 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 17 30 1 0 0 0 0 17 31 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 22 1 0 0 0 0 M CHG 1 12 -1 M END