PUBCHEM-ZINC05113049 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 29 0 0 1 0 0 0 0 0999 V2000 -0.0020 1.4870 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -0.0360 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 -0.5680 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -2.0760 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 -2.6600 -0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8310 -1.9520 -0.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 2.0250 0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 3.5560 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 4.1310 0.0800 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5460 3.7550 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8260 5.6830 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2990 6.0870 -1.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 1.9260 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 1.7890 1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -0.3330 -0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -0.4860 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 -0.3180 0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9640 -0.0730 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 -2.3270 -1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 -2.5840 0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9850 1.6530 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 1.6360 -0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 3.9310 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 3.9170 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8310 -3.8020 -0.9770 O 0 5 0 0 0 0 0 0 0 0 0 0 2.3980 6.2760 1.1050 O 0 5 0 0 0 0 0 0 0 0 0 0 3.4070 3.7410 -1.2760 N 0 3 0 0 0 0 0 0 0 0 0 0 3.5500 4.7290 -1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 3.2550 -1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3310 3.3060 -1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 M CHG 1 25 -1 M CHG 1 26 -1 M CHG 1 27 1 M END