PUBCHEM-ZINC06911884 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 -0.9760 1.0330 -0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 -0.2320 -0.0470 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8230 -1.0350 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 0.1000 1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 -0.0140 0.6760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -0.7040 -1.2780 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -1.2590 -2.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 -1.4740 -2.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -1.6310 -3.5360 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5620 -0.9030 -3.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -3.0510 -3.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 -3.4730 -4.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9530 -5.1330 -4.0940 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9770 -5.3130 -5.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -1.5250 -4.7220 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -1.1680 -5.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -0.9560 -6.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6670 -1.0840 -7.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 -1.0130 -6.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 -0.9150 -8.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9580 -0.8100 -8.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1900 -0.7210 -10.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1470 -0.7330 -10.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -0.8370 -10.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5850 -0.9290 -9.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -1.0400 -8.3710 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -1.1080 -8.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4500 -0.6210 -10.4450 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 1.8490 -0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7410 0.8660 -1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 1.3760 0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -0.5880 -1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 -3.0970 -2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 -3.7630 -3.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 -3.5180 -5.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1040 -2.7600 -4.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 -5.2710 -6.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7340 -4.5250 -5.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4840 -6.2810 -5.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -1.7250 -4.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5990 -1.0040 -5.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7930 -0.7960 -7.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3670 -0.6610 -11.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -0.8430 -11.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 -1.9780 -8.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -1.2260 -10.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 -0.1800 -8.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 0.4280 2.1880 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 48 1 0 0 0 0 6 7 1 0 0 0 0 6 32 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 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 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 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 28 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 M CHG 1 48 -1 M END