PUBCHEM-ZINC05883689 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 0 0 0 0 0 0999 V2000 0.0360 1.4160 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.1060 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 -0.6070 -0.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 -0.8600 -1.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7990 -2.2810 -1.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 -2.5920 -3.3460 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.0610 -2.4290 -2.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 -1.5700 -4.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 -0.8220 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -0.4220 2.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 -0.6140 3.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 -1.2230 3.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9140 -1.6420 2.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 -1.4460 1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9720 -1.4010 4.9100 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 1.7720 -0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 1.8180 -0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 1.8370 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -0.4610 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -0.5100 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1170 -0.6220 -1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 -0.1540 -2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 -2.4540 -2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 -3.0230 -1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 0.0730 2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 -0.2730 4.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8860 -2.1290 2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7810 -1.8090 0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5470 -1.0840 5.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8760 -1.8520 4.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 -3.9590 -3.6790 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 31 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 M CHG 1 31 -1 M END