PUBCHEM-ZINC04715639 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 0 0 0 0 0 0999 V2000 -0.1270 1.8300 -0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 0.1040 0.0510 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 -0.0140 1.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 -0.4680 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 -0.5040 -1.2820 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 -0.0730 -1.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8530 -0.9390 -2.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 -0.6640 -3.8490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6350 -1.2360 -4.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0070 -0.8100 -6.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4170 -1.2990 -7.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4610 -2.2210 -7.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0850 -2.6710 -6.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6690 -2.1760 -5.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0090 -2.8450 -9.0630 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5130 -4.1770 -8.7360 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -2.8370 -9.8510 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1220 -1.8220 -9.5570 N 0 5 0 0 0 0 0 0 0 0 0 0 5.8820 -1.9030 -8.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 2.2830 -0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 1.9230 -1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 2.3070 0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 -0.6320 -2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 0.9730 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8350 -0.1740 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9100 -0.6710 -2.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 -2.0010 -2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -0.0850 -6.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 -0.9590 -8.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8930 -3.3960 -6.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1710 -2.5440 -4.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 5 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 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 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 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 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 M CHG 1 18 -1 M END