CHEMBRIDGE-ZINC02700357 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0220 -0.6890 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.1460 2.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 1.0500 2.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -1.0530 3.4990 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -2.3520 3.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -3.6710 4.2720 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.4480 1.4100 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -0.6390 4.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -0.5140 5.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 -0.0870 6.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 0.0980 7.4220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.7310 -1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1070 -0.6500 -2.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1040 -1.3330 -3.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -2.1040 -3.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 -2.1880 -2.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 -1.5040 -1.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -2.7760 -4.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 -1.3830 5.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 0.3240 4.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 0.2300 4.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 -1.4770 5.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9620 -0.0520 -1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9570 -1.2710 -3.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 -2.7890 -3.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 -1.5670 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -2.2700 -5.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5320 0.0870 7.5080 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 0.3610 8.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 33 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 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 20 32 1 0 0 0 0 33 34 1 0 0 0 0 M END