PUBCHEM-ZINC00014901 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 0.8590 0.9220 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -0.0410 0.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -0.3480 1.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 -0.6070 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -1.9740 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -2.8380 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 -2.4130 -0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 -3.2340 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -4.4750 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 -4.9040 0.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 -4.0940 0.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -4.5520 1.3250 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6350 -5.6050 1.9300 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 -3.8740 1.1390 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.3110 0.2740 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3290 -0.1820 -0.5010 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2190 1.7450 0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 1.2970 0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 0.4090 -1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 1.7560 -0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2540 -2.4020 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -1.4460 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1910 -2.9080 -0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9660 -5.1130 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -5.8730 1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 2.2880 -0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1930 2.1080 0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 1.9020 1.0840 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 15 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M END