PUBCHEM-ZINC04552220 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 40 0 0 0 0 0 0 0 0999 V2000 -0.0690 1.5910 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 0.0740 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4700 -1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -1.9980 -1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 -2.5090 -2.3650 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 -2.7270 -2.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2180 -4.1820 -1.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 -4.4590 -1.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1080 -6.1710 -1.7090 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6520 -6.4120 -0.3420 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3540 -6.8650 -2.7520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 -2.7880 -3.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -2.5200 -3.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -2.8200 -4.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6670 -3.4030 -5.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -3.6700 -5.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 -3.3680 -4.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -3.7110 -7.1070 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 2.0420 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6450 1.9350 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 1.9580 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 -0.2380 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -0.3440 0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -0.1410 -2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 -0.0430 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 -2.2960 -0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 -2.4570 -1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 -2.4140 -3.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3290 -2.0800 -1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8500 -4.4000 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 -4.8620 -2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0980 -4.2030 -2.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2620 -3.8720 -1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 -2.0650 -2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 -2.5910 -4.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -4.1290 -6.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 -3.6260 -4.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 -3.5440 -7.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -4.1040 -7.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5590 -6.1980 -1.8830 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 40 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 M CHG 1 40 -1 M END