IBS-ZINC01836587 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 44 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6190 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 0.1360 2.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 -0.5000 3.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -1.8980 3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -2.6430 2.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -2.0110 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -2.7510 0.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -3.0920 -1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 -4.4030 2.2190 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 -4.8330 0.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 -4.7370 3.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -4.9460 2.3900 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 -4.7250 1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 -5.6230 1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 -5.3910 0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5820 -6.2760 0.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6190 -7.0150 1.6030 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 0.2970 4.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 1.6460 4.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0090 2.4150 5.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 1.8610 6.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 1.2140 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 -2.3930 3.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -3.6820 -1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -2.1800 -1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 -3.6720 -0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 -5.4110 3.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -3.6810 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 -4.9650 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0510 -6.6670 1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8190 -5.3830 2.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6940 -4.3470 0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9260 -5.6310 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9580 -0.1960 5.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9190 2.1390 3.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6090 -6.2420 -0.2150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9590 3.7630 5.1160 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 4.2000 5.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3560 -6.8270 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 41 44 1 0 0 0 0 42 43 1 0 0 0 0 M END