PUBCHEM-ZINC00355591 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.7210 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4120 -0.0450 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6000 -0.7520 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5840 -2.1390 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 -2.8200 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1840 -2.1150 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.8020 -0.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -3.8250 0.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 -4.1930 0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0410 -3.4070 -0.5930 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 -2.5790 -0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 -5.2670 1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 -5.5410 0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5100 -6.5420 1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9950 -7.2740 2.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7260 -7.0060 2.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9670 -6.0030 2.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8060 -8.3470 2.8330 N 0 3 0 0 0 0 0 0 0 0 0 0 5.9240 -8.5840 2.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3550 -8.9920 3.7620 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.7540 -2.8310 0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9610 -2.0660 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -0.4780 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 1.0350 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5410 -0.2240 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 -3.9000 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1810 -4.2570 1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 -1.8360 -1.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1600 -4.9720 -0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5020 -6.7560 0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 -7.5800 3.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -5.7920 2.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8180 -2.7390 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9830 -1.4420 0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0020 -1.4330 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 24 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END