PUBCHEM-ZINC01135852 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 0.0120 -0.4750 1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -1.5280 0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -1.4430 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 -0.3070 -0.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 0.7580 0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 0.6660 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 1.9780 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 2.0140 -0.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 3.0500 0.9520 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 4.1830 0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4700 4.0620 0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2760 5.1820 0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7610 6.4230 0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4400 6.5460 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 5.4300 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8840 7.8990 1.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8870 8.8660 1.4030 F 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 8.2100 0.6790 F 0 0 0 0 0 0 0 0 0 0 0 0 2.4270 7.8780 2.8570 F 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 -0.2020 -1.8250 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2110 -1.4390 -2.5230 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0580 1.0550 -2.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7830 -0.1260 -0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 -1.2400 -0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4860 -1.1800 0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2180 -0.0070 0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7320 1.1060 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5170 1.0460 -1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5200 0.0560 1.0130 N 0 3 0 0 0 0 0 0 0 0 0 0 8.9480 -0.9250 1.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1640 1.0900 1.0080 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7590 -0.5460 2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -2.4200 0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -2.2680 -1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 1.4870 1.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 3.0370 1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8720 3.0940 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3080 5.0900 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3940 7.2970 0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 5.5280 1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6980 -2.1560 -0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8660 -2.0510 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3030 2.0230 -0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1390 1.9150 -1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 28 44 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 M CHG 1 29 1 M CHG 1 31 -1 M END