PUBCHEM-ZINC06561828 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.0180 -1.1780 -0.0040 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 -0.0180 1.4680 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 1.9700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 3.3070 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 4.0340 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7410 3.8390 -0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9300 5.2960 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 5.6810 -1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1360 4.8780 -1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8220 3.3840 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9280 2.9730 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0440 5.2790 -2.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2190 5.7820 -2.0800 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8700 6.0710 -3.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1710 5.7810 -4.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6590 5.1220 -3.8810 S 0 0 0 0 0 0 0 0 0 0 0 0 9.2230 6.6530 -3.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7630 6.8940 -4.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8630 6.9180 -2.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2090 7.4960 -2.1000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.7520 7.1060 -2.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9470 7.1070 -0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0460 8.1630 -0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3320 9.7030 -1.2520 S 0 0 0 0 0 0 0 0 0 0 0 0 11.1040 8.9920 -2.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2890 9.5960 -2.8830 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -2.2280 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8290 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8190 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 5.7900 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3960 5.6010 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 5.4590 -2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0620 6.7460 -1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6300 5.0820 -0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3060 3.1840 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7510 2.8140 -1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4740 3.0920 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 1.9340 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5130 5.9370 -5.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4320 6.7250 -1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2550 7.1060 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3970 6.1200 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2640 8.2670 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9480 7.8970 -1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 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 12 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 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 18 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 26 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 M END