IBS-ZINC00660312 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 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 4.2020 2.2350 -1.3860 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3590 2.8780 -1.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9650 3.4170 -0.7260 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8720 2.9280 -2.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0260 3.5490 -3.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3380 3.4600 -4.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4480 3.9850 -5.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5370 3.7770 -6.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5330 3.0490 -7.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5010 2.5650 -6.7520 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3690 2.7420 -5.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1030 2.1890 -4.3460 S 0 0 0 0 0 0 0 0 0 0 0 0 7.6260 2.8220 -8.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7280 2.1400 -9.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0310 2.0600 -10.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1670 2.6680 -11.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9220 3.4020 -9.9160 S 0 0 0 0 0 0 0 0 0 0 0 0 7.8360 4.2110 -2.3970 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 3.4920 3.1980 0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3930 1.6910 0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 1.8060 -2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2120 4.5440 -4.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3750 4.1690 -7.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8410 1.6930 -9.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3990 1.5440 -11.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5580 2.7050 -12.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5870 4.2440 -1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6530 4.6410 -2.6960 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 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 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 34 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 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 M END