PUBCHEM-ZINC05631687 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 1 0 0 0 0 0999 V2000 1.2930 0.3980 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 0.1740 -0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 0.3480 -1.6530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -0.3140 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -1.7690 -0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -2.1450 0.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 -2.6120 -1.8720 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 -4.0870 -1.7810 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4090 -4.4720 -0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -4.9240 -2.8920 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5620 -5.8560 -2.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 -5.1120 -3.4450 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 -4.6280 -2.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 -4.5420 -2.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -5.5740 -4.8060 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2460 -4.9760 -5.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -5.2200 -5.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 -4.0910 -4.3220 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -4.4320 -6.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -6.4110 -5.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8190 -7.0520 -4.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 -7.8140 -3.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 1.0310 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 -0.5610 1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 0.9060 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 0.2770 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 -0.1300 -2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 -2.2210 -2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -3.5270 -6.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -4.1280 -7.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 -5.0410 -7.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -7.0870 -6.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 -6.0820 -6.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -6.9970 -4.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3400 -7.3290 -6.0890 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 M CHG 1 35 -1 M END