IFLAB-ZINC02922971 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 0 0 0 0 0 0999 V2000 0.2690 1.5240 -1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 0.1500 -1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -0.5320 -1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6490 0.1250 -0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6090 1.5230 -0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 2.2050 -0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7980 2.1560 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9520 1.3770 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8740 0.0060 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7470 -0.6130 -0.5560 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0540 -0.8920 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3690 -0.1280 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2920 1.0240 0.9660 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2510 2.0100 0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7580 1.6680 1.5530 S 0 0 0 0 0 0 0 0 0 0 0 0 8.4690 2.7500 2.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6100 0.5690 1.9640 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5010 2.3890 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2420 3.7260 -0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8510 4.2970 -1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7250 3.5360 -2.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0000 2.2080 -1.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3900 1.6300 -0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4770 4.2450 -3.4840 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.8550 3.6470 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9840 4.1540 0.8570 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6480 2.0700 -1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -0.3930 -1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -1.6100 -1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 3.2830 -0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9370 -1.3320 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0620 -1.7110 -0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1820 -0.8040 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5550 0.2240 -0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6460 2.5950 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0470 2.6630 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5630 4.3250 0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6390 5.3320 -1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6880 1.6200 -2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6130 0.5980 -0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7940 4.2660 -0.5020 O 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 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 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 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 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 2 0 0 0 0 M CHG 1 26 -1 M END