PUBCHEM-ZINC05378264 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 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 0.0200 -0.6160 1.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6720 -1.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0560 -1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.8550 -2.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -4.2530 -1.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -4.1710 -0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -2.8560 -0.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -2.5330 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -5.5380 0.6800 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -4.6580 2.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -5.4700 -2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 -5.9620 -2.9720 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 -6.0470 -2.9850 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -2.4100 -3.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -2.2110 -4.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 -2.2220 -4.3290 N 0 0 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 -0.0140 -0.1820 -2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -5.3790 3.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -4.0200 2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 -4.0450 2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 -5.6550 -2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -6.8550 -3.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 -2.3810 -3.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -1.9270 -5.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 22 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 16 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 28 1 0 0 0 0 18 29 1 0 0 0 0 M END