PUBCHEM-ZINC06520211 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 0.3870 0.6770 -0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -0.7570 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -1.7220 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 -1.4080 -0.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 -2.9990 0.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 -3.6680 0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -3.3550 0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -4.5130 0.9040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 -2.4490 0.6320 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -1.1340 0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4930 0.0530 0.3430 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4020 -0.4620 -1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9010 -1.4660 -1.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6160 -1.8680 -3.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8290 -1.2730 -3.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3300 -0.2740 -2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6230 0.1290 -1.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1630 1.1940 -0.4980 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.2340 1.7120 -0.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5370 1.5520 0.4830 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.8060 -2.8640 0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8920 -3.0720 2.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -1.8660 3.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 -2.2070 4.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8590 -2.8100 5.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 0.7770 -0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 0.9710 -1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 1.3190 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 -1.9300 -1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2270 -2.6470 -3.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3860 -1.5890 -4.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2770 0.1890 -2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5110 -2.0880 0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0480 -3.7920 0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -1.2430 2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8990 -1.3280 2.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2560 -1.2960 5.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9070 -2.9020 4.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8410 -3.0530 5.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 10 2 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END