PUBCHEM-ZINC06908543 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 -0.3890 1.9180 -1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 0.4680 -0.6060 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3780 0.5180 0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -0.3670 -1.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 -1.4740 -1.9850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 0.2260 -1.8780 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 -0.3390 -2.7500 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4650 -1.0680 -3.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0600 -0.9800 -1.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 -2.2550 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8550 -2.9360 -0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5810 -2.2000 0.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 0.7970 -3.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4610 1.9570 -3.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -0.2510 -0.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 -0.9920 0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 -1.0280 1.6990 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7500 -1.7620 1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8910 -2.5440 2.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0680 -3.2620 2.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1010 -3.1960 1.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9580 -2.4120 0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7770 -1.6980 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 -0.9170 -0.9740 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3650 -0.8560 -1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 -0.1940 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 0.4640 -2.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 2.4990 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 1.9900 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 2.4060 -0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 1.1550 -1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9010 -1.2200 -2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4480 -0.2510 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9210 -2.0290 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1710 -2.9510 -1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 -2.6000 2.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1800 -3.8740 3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0180 -3.7570 1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7690 -2.3710 -0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9790 -4.1700 -0.7960 O 0 5 0 0 0 0 0 0 0 0 0 0 4.1740 0.4410 -4.6480 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 15 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 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 40 1 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 16 17 2 0 0 0 0 16 18 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 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 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 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 M CHG 1 40 -1 M CHG 1 41 -1 M END