PUBCHEM-ZINC05325993 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 38 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 0.6820 -0.4720 -1.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -1.8010 -1.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 -2.5480 -0.5230 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -2.3610 -2.5690 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2090 -1.7710 -3.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 -2.3050 -2.3640 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2640 -2.8950 -1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 -2.8650 -3.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0710 -4.1920 -3.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7060 -4.7060 -4.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9560 -3.8920 -5.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5710 -2.5650 -5.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9320 -2.0520 -4.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6380 -4.4420 -7.0040 N 0 3 0 0 0 0 0 0 0 0 0 0 5.9780 -5.6120 -7.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8580 -3.7250 -7.9630 O 0 5 0 0 0 0 0 0 0 0 0 0 3.3980 -0.9480 -2.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -3.7520 -2.7700 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 -4.1040 -3.8040 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -5.5160 -3.7250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 -3.2440 -3.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -3.6130 -5.4380 C 0 0 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 0.5290 -0.3650 0.8850 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 3.8750 -4.8280 -2.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0070 -5.7430 -4.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7670 -1.9290 -6.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6280 -1.0160 -4.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1890 -0.3640 -2.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -4.4660 -2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 -4.1830 -5.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -3.8120 -6.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -2.5490 -5.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 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 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END