IBS-ZINC02315992 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0290 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4120 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 2.1840 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1610 2.3450 -1.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4190 3.0950 -1.4690 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0400 3.3590 -2.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5540 2.9730 -3.6850 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2560 4.0840 -2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9560 4.4000 -3.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1730 5.1490 -3.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1300 5.6370 -4.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2090 6.3240 -3.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3480 6.5340 -2.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4460 6.0720 -1.7360 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3720 5.3930 -2.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0520 4.7000 -1.2090 S 0 0 0 0 0 0 0 0 0 0 0 0 12.5160 7.2780 -2.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7630 7.5440 -0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9190 8.2560 -0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6190 8.5740 -1.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8050 7.9480 -3.0670 S 0 0 0 0 0 0 0 0 0 0 0 0 7.5440 4.0370 -5.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9120 -0.8180 -0.0380 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 3.1660 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 3.1680 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4200 1.6440 0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3220 1.3610 -1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4120 2.8850 -2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8060 3.4020 -0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0070 5.4660 -5.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9520 6.7050 -4.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1060 7.2250 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2380 8.5380 0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5460 9.1280 -1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7220 3.5360 -5.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0780 4.2850 -5.8090 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 30 1 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 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 M END