PUBCHEM-ZINC05592638 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 0.0360 1.4150 0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.0790 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -0.8870 1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -2.2820 1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.8860 -0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -2.0980 -1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -0.6910 -1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 0.1190 -2.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -0.1370 -3.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 -0.1470 -3.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 -2.9240 2.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 -4.3510 2.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 -4.8110 3.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 -5.2020 4.3800 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -5.5840 5.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 -5.4800 5.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 -4.8890 4.4480 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 -5.8210 7.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 -6.2260 8.0700 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3440 -6.0460 6.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 1.8550 -0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 1.8470 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 1.6980 1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 -0.4270 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -3.9640 -0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 -2.6020 -2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 1.1890 -2.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 -1.1710 -3.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 0.5170 -4.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8910 0.0630 -3.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4150 0.0470 -2.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 0.5060 -4.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6630 -1.1820 -3.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 -4.6970 1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -4.7560 1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -7.0790 6.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 -5.4040 7.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 -6.0150 6.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0470 -5.6980 7.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 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 24 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 27 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 39 2 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 M CHG 1 19 -1 M END