CHEMDIV-ZINC06751461 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 27 0 0 1 0 0 0 0 0999 V2000 0.0410 1.5790 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 0.0570 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 -0.5410 1.2290 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6980 -0.1300 1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 -2.0830 1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -2.6250 2.2200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -0.1450 2.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 -0.5390 2.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 -1.1990 1.9210 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 -0.0310 3.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1150 -0.2460 4.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3840 0.3130 5.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 1.0700 6.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 1.2760 5.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 0.7170 4.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 0.8330 3.6560 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 2.0090 0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 1.9490 -1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 1.9480 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 -0.3360 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -0.2480 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8620 -0.8360 3.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3560 0.1590 6.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 1.4980 7.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 1.8620 6.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -2.6200 0.0180 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 2 0 0 0 0 5 26 1 0 0 0 0 7 8 1 0 0 0 0 7 16 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 15 2 0 0 0 0 11 12 2 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 M CHG 1 26 -1 M END