PUBCHEM-ZINC02584240 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 39 0 0 0 0 0 0 0 0999 V2000 -0.9420 1.3420 -0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 -0.0670 -0.4600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -0.5810 -1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 0.2070 -2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -0.4080 -3.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 -1.7900 -3.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -2.6500 -2.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 -1.9980 -1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 -2.7890 -0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -4.1810 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 -4.8970 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -4.1070 -2.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 -4.8340 -3.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 -6.1950 -3.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -6.9540 -2.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -6.3200 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 -7.1890 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -6.6470 1.1110 O 0 5 0 0 0 0 0 0 0 0 0 0 2.9500 -6.6810 -4.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1990 -5.4800 -5.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 -4.3180 -4.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 -4.8570 0.4440 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9400 -5.6830 -0.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -4.4460 1.6120 O 0 5 0 0 0 0 0 0 0 0 0 0 2.1880 0.3120 -4.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 1.8600 -0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 1.7090 -1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6140 1.5590 0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 1.2820 -2.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 -2.1730 -4.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 -2.3180 0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9380 -8.0180 -2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2820 -5.3290 -5.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 -5.5930 -6.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 1.2510 -4.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 -8.3910 -0.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 36 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 35 1 0 0 0 0 M CHG 1 18 -1 M CHG 1 22 1 M CHG 1 24 -1 M END