PUBCHEM-ZINC05290986 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 26 0 0 0 0 0 0 0 0999 V2000 0.0810 1.4260 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -0.0790 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 -0.7340 -0.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -0.7520 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4030 -0.0380 0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5480 -0.6260 -0.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7170 0.1310 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9520 -0.5000 -0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1070 0.2520 -0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0360 1.6340 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8090 2.2660 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6500 1.5200 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2760 2.4370 -0.3590 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.3570 1.8820 -0.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2150 3.6540 -0.3480 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3560 -2.2140 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 -2.8690 0.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 1.7420 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 1.8200 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 1.8050 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -1.5950 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0080 -1.5790 -0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0660 -0.2380 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7570 3.3450 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6920 2.0140 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 -2.7100 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 2 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M END