PUBCHEM-ZINC06474840 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1360 -0.9460 -1.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4390 -0.5570 -2.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2840 -1.5880 -1.7210 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6480 -1.7930 -2.9420 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7900 -2.4320 -3.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3520 -2.7480 -4.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9280 -2.5110 -5.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6990 -2.9430 -6.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8920 -3.6100 -6.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3220 -3.8500 -5.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5590 -3.4220 -4.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7340 -3.5180 -2.9200 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4930 -3.9420 -2.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7040 -2.9350 -2.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5760 -2.8540 -0.9230 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2520 -2.6940 -8.2800 N 0 3 0 0 0 0 0 0 0 0 0 0 6.2040 -2.1090 -8.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9310 -3.0750 -9.2160 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9980 -1.9920 -6.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4890 -3.9450 -7.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2530 -4.3710 -5.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1140 -3.5800 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 21 2 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 36 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END