PUBCHEM-ZINC04703648 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 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 0.0230 -0.7020 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0840 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7730 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0820 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6930 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 0.0100 -2.4110 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -0.3020 -3.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 0.6170 -4.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 0.5010 -5.1530 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 0.6650 -4.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2760 -0.2570 -3.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 0.1940 -6.7790 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 0.6770 -7.2330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 0.6310 -7.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -1.5570 -6.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -2.2210 -7.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 -3.5940 -7.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 -4.3030 -7.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -3.6380 -7.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -2.2650 -7.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -2.8290 2.4660 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0660 -2.2230 3.5230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -4.0460 2.4620 O 0 5 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 0.0250 -0.1670 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -3.8530 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.6210 -2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 -0.1470 -2.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 -1.3410 -3.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 1.6480 -4.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 0.3150 -5.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 1.7010 -4.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2090 0.3940 -4.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -1.2960 -3.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -0.0680 -2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3480 -1.6670 -6.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4020 -4.1130 -7.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 -5.3760 -7.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 -4.1920 -7.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 -1.7450 -7.0760 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END