PUBCHEM-ZINC06021122 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 40 0 0 1 0 0 0 0 0999 V2000 2.4210 1.6400 1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 0.1580 1.3570 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5590 -0.3590 2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 -0.0910 1.4190 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0880 0.4460 0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 -1.6090 1.2450 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6670 -2.1440 2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -1.9520 1.2010 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7250 -1.6790 2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 -3.4750 1.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0080 -3.8390 0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0140 -3.8560 0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1360 -5.3430 0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 -6.1530 1.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3440 -5.8910 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3020 -5.0680 -0.1950 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9560 -4.1530 2.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 -5.1100 1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0190 -1.1220 0.2270 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6530 -0.4160 0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 -1.1960 -1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 -1.8970 -1.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7430 -0.2930 -1.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -2.0900 0.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -2.0940 -0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 0.4420 2.6650 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 0.3090 3.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 1.1060 2.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 1.3120 1.7830 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 -0.3560 0.1460 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 -1.2060 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 2.0970 2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5030 1.7780 1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 2.1860 0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5400 -3.6290 1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4930 -3.3220 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 0.6870 -2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 -0.7250 -2.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7110 -0.1740 -1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 1.4400 3.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 -7.0890 -0.4730 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 26 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 24 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 41 2 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 28 40 1 0 0 0 0 30 31 1 0 0 0 0 M CHG 1 16 -1 M END