PUBCHEM-ZINC05674553 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 1.4120 2.4170 -2.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 1.3480 -1.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1370 -0.0160 -2.1270 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3340 -0.3670 -2.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4070 0.1470 -2.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -1.0750 -1.0090 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2140 -0.7310 -0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -1.1930 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -1.5360 -0.6570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 -2.3670 -1.6200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 -2.5970 -2.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4130 -3.3570 -0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8940 -4.5050 -1.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8080 -4.8330 -3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3600 -6.0410 -3.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9880 -6.9240 -2.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0840 -6.6030 -1.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5650 -5.4260 -0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7580 -5.2560 0.4560 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2910 -4.1270 0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6450 -3.1690 0.3310 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1710 -3.9450 -4.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6430 -4.0160 -5.3330 O 0 5 0 0 0 0 0 0 0 0 0 0 2.3190 2.7360 -3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 2.0540 -3.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 3.3020 -2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 1.7190 -0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 1.2240 -0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 -0.8070 -3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2290 0.8040 -3.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2260 0.5720 -2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2960 -6.2860 -4.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4060 -7.8520 -3.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5880 -7.2960 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4490 -3.9740 2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -0.8610 1.1170 O 0 5 0 0 0 0 0 0 0 0 0 0 2.2030 -3.2040 -3.7910 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 21 2 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 22 23 1 0 0 0 0 22 37 2 0 0 0 0 M CHG 1 23 -1 M CHG 1 36 -1 M END