PUBCHEM-ZINC05503970 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 32 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 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 0.0230 -0.6930 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0850 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7790 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0490 -1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 0.0880 -2.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.1220 -0.0720 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0780 -4.8200 1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -6.2960 1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -6.9310 0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -6.9120 2.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -7.8810 2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -6.2090 3.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -6.8250 4.4410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -4.8800 3.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -4.1430 2.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -2.7800 2.3840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -2.0920 3.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -4.7920 -1.3190 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1550 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.5680 -2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 0.2900 -2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -0.4950 -3.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 1.0310 -2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -2.6720 4.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 30 1 0 0 0 0 M CHG 1 9 1 M CHG 1 21 -1 M END