CHEMBRIDGE-ZINC00995022 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2440 -0.6510 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 0.1230 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 1.4390 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 2.0740 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 -0.6550 -0.0390 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -2.1260 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 -2.6770 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -2.8610 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -4.2480 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 -5.0520 -0.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -6.3520 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 -6.6780 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 -5.1870 -0.0490 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 -7.3760 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9010 -6.9870 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8950 -7.9440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5650 -9.2870 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 -9.6790 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 -8.7310 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6360 -10.3100 -0.0040 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.8050 -9.9670 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3480 -11.4930 -0.0130 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9560 1.9120 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -0.5700 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 3.1540 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 -2.4210 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -7.6800 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 -5.9380 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9320 -7.6440 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9870 -10.7300 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -9.0380 -0.0500 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 6 27 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END