IBS-ZINC02341114 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 1 0 0 0 0 0999 V2000 -0.2640 1.6300 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 0.6590 0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2870 -0.0040 0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 0.2940 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 1.2820 -1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 1.9390 -1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5530 -0.4230 -0.1700 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3620 -1.4540 0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2060 -0.5420 -1.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0070 0.2820 -2.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7870 -1.6480 -2.2870 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3100 -1.9660 -3.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 -1.3510 -4.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9230 -1.7430 -6.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8850 -2.5570 -6.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5270 0.1700 0.7550 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3530 -0.6550 1.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3130 -1.8820 1.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3230 0.0260 2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2380 -0.6830 3.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1470 0.0160 3.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1330 1.4100 3.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2100 2.1030 3.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2930 1.4110 2.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3870 2.1390 1.5530 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5820 1.5390 0.8090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 2.1480 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 0.4210 1.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -0.7550 1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5620 1.5630 -1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 2.7010 -1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0870 -2.2730 -1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3470 -1.6170 -3.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3170 -3.0590 -3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 -1.6670 -4.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4760 -0.2570 -4.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2460 -1.7700 3.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8640 -0.5230 4.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8410 1.9600 4.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2090 3.1900 3.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2630 -1.2010 -7.0370 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 M CHG 1 41 -1 M END