PUBCHEM-ZINC05764985 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 1.3700 0.2600 1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -0.4560 1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -0.9370 1.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 -1.4590 1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -1.3040 -0.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 -0.6860 -0.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1110 -2.1230 1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2920 -1.9640 0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3350 -2.7600 1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8960 -3.4930 2.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2340 -3.2280 2.7460 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 -0.8360 3.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 -0.5450 4.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -1.0850 3.9000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 -0.9600 5.3580 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3190 -1.8050 5.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 0.4460 5.9770 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2940 1.2650 5.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 0.4000 6.3610 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 -0.7050 5.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 -1.3060 5.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 1.3020 7.3930 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1540 2.3070 7.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 1.0010 8.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 0.5670 7.6350 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 2.2170 9.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 -0.2340 9.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9060 1.3570 7.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5920 1.6240 6.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 -0.4510 1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 0.8360 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 0.9580 1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4150 -1.3150 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3520 -2.7940 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4670 -4.1740 3.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -1.3750 3.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 3.0870 8.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 2.0130 10.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 2.5050 9.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 -0.0500 10.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 -0.5100 10.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -1.1050 8.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2940 1.2010 8.8130 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 12 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 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 25 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 26 37 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 28 29 2 0 0 0 0 28 43 1 0 0 0 0 M CHG 1 43 -1 M END