PUBCHEM-ZINC04688514 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 0 0 0 0 0 0999 V2000 0.0650 1.3660 0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -0.0180 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -0.6880 0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 0.0600 0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 1.3760 0.7240 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 2.0350 0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 -2.1700 0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 -2.8510 0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -4.5720 0.5150 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -4.2050 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -2.9190 0.2060 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -5.1440 -0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -6.4980 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1040 -7.4670 0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 -8.8040 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 -9.1770 -0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -8.2140 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -6.8760 -0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -10.6110 -0.4820 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0000 -11.4600 -0.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 -10.9410 -1.0240 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8480 1.9170 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 -0.5660 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3640 -0.4450 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 3.1150 0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4380 -2.4170 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5010 -4.8620 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -7.1760 0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -9.5580 0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 -8.5090 -1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 -6.1250 -1.1550 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 31 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END