PUBCHEM-ZINC01057764 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2060 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0310 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4190 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 -0.6510 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 -0.0730 -0.0450 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3350 -0.0460 -1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2860 1.2220 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1150 1.0430 0.8620 S 0 0 0 0 0 0 0 0 0 0 0 0 7.5020 1.4670 2.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7600 1.5840 -0.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1540 -0.7990 0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6960 -1.1620 0.7870 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3320 -1.0600 1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1030 -2.3530 0.2570 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8150 -2.0040 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 -2.8100 -0.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7100 -3.6030 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0380 -3.7870 0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6330 -5.0220 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9090 -6.0730 -0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5860 -5.8920 -0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9830 -4.6620 -0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8140 -7.0200 -1.1840 N 0 3 0 0 0 0 0 0 0 0 0 0 5.3440 -8.1070 -1.3330 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 -6.8620 -1.5020 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 1.9750 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 3.1690 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0340 2.0900 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7950 1.2710 1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6380 -1.1340 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6540 -1.2130 1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6050 -2.9660 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6660 -5.1660 0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3770 -7.0370 -0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9490 -4.5230 -0.7190 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 41 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END