PUBCHEM-ZINC05732436 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 0.1010 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6050 -0.5520 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6500 -1.9540 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4700 -2.6800 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -2.0260 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -2.8090 -0.0250 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0380 -4.0260 -0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -2.2360 -0.0320 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.8450 -2.5980 0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8130 -4.0260 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7630 0.1710 0.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7180 1.4600 0.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8780 2.1840 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8340 3.5810 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0080 4.3050 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2270 3.6510 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2790 2.2680 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1130 1.5310 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 1.1810 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 -3.7590 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2820 -4.3830 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8320 -4.4130 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3000 -4.3730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8820 4.0920 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9750 5.3840 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1430 4.2230 0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2340 1.7650 0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1550 0.4520 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 12 13 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 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 34 1 0 0 0 0 M CHG 1 9 1 M CHG 1 11 -1 M END