IBS-ZINC04813112 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 37 0 0 0 0 0 0 0 0999 V2000 -0.9460 1.4860 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 0.0310 -0.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 -0.5750 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 0.0480 2.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 -2.0450 1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -2.7290 2.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -2.2470 3.5650 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -3.0360 4.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 -2.1570 5.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -2.9830 7.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -3.0280 9.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 -1.0850 8.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -2.8020 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 -4.0190 -0.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -2.0300 -1.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -0.6680 -1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0180 -2.7780 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 1.9420 -0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 1.7320 -0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 1.9160 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -3.8100 2.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -1.2290 3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 -3.8300 4.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -3.5150 4.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -1.3510 5.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -1.6800 6.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -3.8150 7.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 -3.3810 7.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 -3.5610 9.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -3.7250 9.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -2.3850 10.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5410 -0.3770 7.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 -1.5620 8.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 -0.5650 9.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -2.5400 -2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -2.1530 8.4980 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3080 -1.6750 8.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 10 36 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 11 36 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 36 37 1 0 0 0 0 M CHG 1 36 1 M END