PUBCHEM-ZINC05515082 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 0.1010 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5450 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9270 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -2.6650 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -2.0230 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.8290 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -3.0060 1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -2.5260 2.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 -3.6980 1.6080 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 -3.8620 2.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 -3.3920 3.9680 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -3.6420 5.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2580 -4.3580 5.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 -4.7190 3.3370 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1110 -4.7810 6.1710 N 0 3 0 0 0 0 0 0 0 0 0 0 3.8060 -4.4740 7.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 -5.4360 5.9650 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1800 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0300 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6030 -2.4300 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -3.7440 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -3.8060 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -2.3060 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 -4.0820 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 -3.2950 6.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END