PUBCHEM-ZINC05840672 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -2.0420 1.4760 P 0 0 3 0 0 0 0 0 0 0 0 0 1.4480 -2.9210 -0.0760 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 -2.7610 2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 -2.2120 2.6110 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 -3.4460 3.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8670 -4.4400 2.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 -5.6940 3.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1320 -5.9580 4.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -4.9690 4.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 -3.7120 4.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 -7.3030 4.9520 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8690 -8.1750 4.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -7.5370 5.9390 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 -2.6460 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -3.8200 2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -2.2470 2.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4650 -4.2340 1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -6.4680 2.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -5.1780 5.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -2.9380 4.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END