PUBCHEM-ZINC05660055 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -0.6330 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 0.0160 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -2.0980 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4770 -2.7450 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5320 -4.1480 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6860 -4.9180 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2810 -6.2510 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 -6.2540 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 -4.9820 -0.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 -7.4550 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -8.4820 0.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 -9.6010 0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 -9.7080 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -8.6940 -0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -7.5720 -0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 -6.4910 -1.9540 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1110 -6.5950 -2.7720 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 -5.4980 -1.9460 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0370 -2.8610 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -3.4670 -0.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3910 -2.1690 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7030 -4.5540 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9250 -7.1180 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 -8.4000 1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 -10.3960 1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -10.5860 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 -8.7830 -1.6950 H 0 0 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 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 3 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END