PUBCHEM-ZINC06521147 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0220 -0.6940 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.0620 1.1370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7260 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.9420 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0630 -1.2050 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.5570 -2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.7150 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.1140 -2.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.8120 2.3950 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1630 -2.1330 3.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 -3.6770 2.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 -4.7970 3.4970 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1430 -5.7610 3.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -4.7830 3.3670 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1320 -3.7820 2.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -6.1540 2.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7120 -6.1310 2.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 -4.4420 4.6570 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -4.3830 4.7540 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6340 -4.3240 4.8520 N 0 5 0 0 0 0 0 0 0 0 0 0 -1.1370 -4.5050 4.8390 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 -5.0520 5.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1690 2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 -3.1020 2.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 -4.0900 1.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 -6.9110 3.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -6.3900 1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 -6.9690 2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3760 -6.1370 5.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6320 -4.7860 6.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1770 -4.6490 4.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 20 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 24 34 1 0 0 0 0 24 35 1 0 0 0 0 24 36 1 0 0 0 0 M CHG 1 21 1 M CHG 1 22 -1 M END