PUBCHEM-ZINC00205455 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 -0.0720 1.5020 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -0.0050 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -0.7190 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -2.1300 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -2.7990 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -2.0990 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -0.6980 -1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 0.0410 -2.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 1.2530 -2.4770 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -0.0280 2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 -0.3050 3.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 0.5790 4.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 1.4120 3.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 0.9920 2.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 2.4530 4.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 3.1480 3.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 4.2540 4.6030 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9140 4.5650 5.8520 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1180 4.9260 3.9490 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9220 1.8990 -0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 1.8480 -0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 1.8470 0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -2.6830 2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -3.8790 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -2.6350 -2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 -1.0670 3.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 0.6590 5.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 2.7080 5.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 2.8940 2.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 -0.6310 -3.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 -0.1040 -4.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 30 31 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END