CHEMBRIDGE-ZINC00454430 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 0.0400 0.7550 1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -0.7220 1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -1.5020 2.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -1.2420 1.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -2.2060 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -2.7240 -0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 -3.7050 -1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 -4.1770 -1.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 -3.6630 -0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8090 -2.6760 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4550 -4.1660 -1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3580 -3.7170 -0.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7090 -5.1220 -2.0840 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 -5.5810 -2.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2390 -4.9480 -1.2930 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.2210 -6.5370 -3.1620 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5350 -6.9690 -3.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5800 -6.0540 -3.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8750 -6.4840 -3.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1330 -7.8240 -3.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0960 -8.7380 -3.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7960 -8.3140 -3.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4940 -9.4610 -3.6360 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 1.1520 1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 1.3110 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 0.8550 2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 -0.8220 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -2.5550 1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 -1.1060 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -1.4030 3.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -2.3590 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -4.1040 -2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 -4.9430 -2.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6080 -2.2780 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9880 -5.4810 -2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4940 -6.9260 -3.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3790 -5.0080 -3.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6880 -5.7730 -3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1480 -8.1570 -3.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3010 -9.7840 -3.9880 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 2 4 1 0 0 0 0 2 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 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 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 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 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 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 1 0 0 0 0 M END