PUBCHEM-ZINC03080632 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3770 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 1.2130 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0340 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.4140 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.5660 0.0100 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0830 4.1590 0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1930 4.1910 0.0040 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6970 -0.6850 -0.0370 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7420 -0.0580 -0.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7180 -1.9020 -0.0430 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2340 -2.0390 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -2.7070 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 -4.2210 -0.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8400 -4.4980 0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 -4.9360 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 -6.3440 0.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -4.6020 -1.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9700 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 -2.4280 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 -2.4190 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 -4.5790 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 -4.7300 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 -6.8620 0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -4.3860 -2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 19 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 17 26 1 0 0 0 0 18 27 1 0 0 0 0 19 28 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M CHG 1 10 1 M CHG 1 12 -1 M END