IBS-ZINC01793569 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.1240 1.5410 1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 0.2070 1.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 -0.4760 1.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 0.1740 1.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 1.5080 1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 2.2040 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 3.6320 0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 4.3870 0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 5.6750 0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 5.6530 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 4.4030 0.6410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 6.7450 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 6.5540 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5090 5.2860 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 4.2080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8230 5.3980 -0.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3770 6.6140 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0470 6.9680 -0.3680 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 7.7870 -0.1690 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6660 4.2000 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0620 3.8210 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9280 2.5880 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2010 2.0660 0.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -2.1810 2.3560 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 -2.4480 2.9780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 -2.4140 2.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -3.0540 0.9500 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 2.0720 1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 -0.3070 1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 -0.3650 1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2360 2.0150 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2530 4.0510 0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 6.5240 0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 7.7320 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5630 4.4000 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1130 3.3770 -0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1640 3.6200 1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6150 4.6430 1.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 -2.5970 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 -4.0240 0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3970 2.0700 2.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9490 1.2790 2.2810 H 0 0 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 2 0 0 0 0 17 19 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 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 39 1 0 0 0 0 27 40 1 0 0 0 0 41 42 1 0 0 0 0 M END