PUBCHEM-ZINC04582449 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 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 0.6260 -0.6180 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1400 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -0.4830 3.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 -1.8620 3.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -2.6260 2.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -2.0020 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -4.0200 2.2200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0220 -4.6500 3.2930 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -5.7730 4.2010 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 -6.3280 5.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -5.1500 4.6330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -7.0750 3.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -8.1500 2.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -9.1720 2.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -9.1180 1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -8.0430 1.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 -7.0240 2.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 -7.9860 0.9210 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.4990 -8.8850 0.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9130 -7.0390 1.1010 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 1.1640 1.2180 2.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.1090 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 -2.3470 3.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -2.5930 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -4.5530 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 -4.4270 3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5310 -8.1920 3.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 -10.0110 1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 -9.9160 0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 -6.1860 2.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END