PUBCHEM-ZINC06293334 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 1 0 0 0 0 0999 V2000 -0.0690 1.2800 0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -0.0550 0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 -0.6980 0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -1.5420 2.3150 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 -2.4380 1.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -2.1580 0.9120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -1.0080 0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9880 -0.4630 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -1.5040 -1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -2.1050 -1.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 -3.6390 2.7760 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5530 -4.1830 2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 -3.1210 4.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -3.3870 5.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -4.5740 2.8410 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 -5.5270 1.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -5.7440 0.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 -6.3350 2.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -7.5270 3.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -8.5830 2.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 -9.5270 3.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -9.1680 4.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 -7.7000 4.6210 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 1.9580 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 1.7230 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 -1.4050 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1550 0.0420 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 -4.4680 3.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 -6.6590 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7100 -5.6990 2.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -8.6590 1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -10.4190 3.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 -9.6930 5.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -1.2090 -2.2270 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.1960 -2.5290 4.2790 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 15 1 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 31 1 0 0 0 0 21 22 2 0 0 0 0 21 32 1 0 0 0 0 22 23 1 0 0 0 0 22 33 1 0 0 0 0 M CHG 1 34 -1 M CHG 1 35 -1 M END