PUBCHEM-ZINC04313793 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8460 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 -2.6790 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -4.0490 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 -4.6040 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9360 -3.7920 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7840 -2.4020 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9710 -1.5270 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8350 -0.3190 0.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2060 -2.0670 0.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3240 -1.2420 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2910 0.0540 0.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4520 0.6810 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5170 -0.1240 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9440 -1.7890 0.0920 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.9330 0.3090 0.1390 N 0 3 0 0 0 0 0 0 0 0 0 0 -10.2070 1.4950 0.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.8230 -0.5220 0.1470 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -2.2540 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -4.6940 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 -5.6770 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9230 -4.2280 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3140 -3.0310 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5340 1.7580 0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 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 30 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END