PUBCHEM-ZINC04099756 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 -0.0600 1.6710 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 0.1390 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0590 -0.1780 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -0.3950 1.3090 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4690 -1.4800 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7790 -0.9840 0.0960 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4670 -2.0290 0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 -0.4700 -1.2470 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5350 -1.1640 -2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -0.5470 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -0.1510 -2.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 0.7910 -2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7700 0.8950 -1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2840 -0.9710 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1580 -1.8820 -0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5220 -1.5720 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6510 -0.4370 0.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1360 0.2470 1.0340 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 0.1930 2.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 -0.1510 3.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 0.6030 4.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 1.4970 4.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 1.4250 3.4510 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 2.1410 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 2.0120 -1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 2.0710 0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 -1.6150 -1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8320 0.8100 -1.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 1.2730 -2.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 1.6510 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8400 -2.7360 -0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3670 -2.1530 -0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5650 0.0220 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8160 -0.9090 2.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2680 0.4950 4.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 2.1910 5.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1260 -0.2480 1.2250 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3870 0.7470 1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 -0.5950 2.1070 H 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 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 4 37 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 6 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 M CHG 1 37 1 M END