PUBCHEM-ZINC05511830 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 1 0 0 0 0 0999 V2000 -0.3340 1.5450 0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 0.0660 0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 -0.5790 -0.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -1.9330 -0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 -2.5160 -1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -3.8920 -1.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -4.7070 -1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 -4.1270 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -2.7450 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 -6.1690 -1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 -6.6610 -1.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -6.8850 -1.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -6.4150 -0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -8.3330 -1.1380 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6140 -8.5310 -2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 -8.8130 -0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1670 -7.8840 -1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 -6.6640 -0.7200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4570 -9.0900 -0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7190 -8.8840 0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 -9.5600 1.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5590 -10.4510 0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 -10.6620 -0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 -9.9930 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 -11.5900 -1.2450 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.1670 -12.0440 -0.6790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8200 -11.8770 -2.4020 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1580 1.9770 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 1.6970 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 2.0890 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 -0.0570 0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 -0.3430 1.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 -1.8940 -2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 -4.3220 -2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 -4.7290 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -2.3390 0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 -8.8410 0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 -9.8380 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 -8.1790 1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9430 -9.3820 2.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 -10.9620 1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -10.1490 -2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1490 -8.4350 -1.5900 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M CHG 1 43 -1 M END