PUBCHEM-ZINC02164956 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 0.1140 1.9380 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 1.8500 -1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6730 1.5850 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 1.6730 -1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 1.7220 -2.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 1.4290 0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8400 2.1550 0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4750 1.9220 1.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9790 0.9700 2.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8440 0.2480 2.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2030 0.4670 1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6650 0.7250 3.9290 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.6640 1.3600 4.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2320 -0.1120 4.7010 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0090 1.9500 -2.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 1.8790 -3.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 2.1250 -2.3520 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0220 2.1360 -3.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 2.6920 -4.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 2.7010 -5.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 2.1570 -5.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9610 1.6020 -4.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2970 1.5940 -3.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 0.9360 0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 2.5260 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 2.4170 0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2280 2.8980 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3600 2.4830 2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4630 -0.4930 3.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 -0.1020 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 2.2440 -1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 3.1180 -4.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6280 3.1340 -6.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8850 2.1650 -6.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9520 1.1770 -4.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 1.1640 -2.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 4 2 0 0 0 0 2 15 1 0 0 0 0 3 5 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 22 2 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 23 36 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M END