PUBCHEM-ZINC02981010 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 49 0 0 0 0 0 0 0 0999 V2000 -0.4860 2.7860 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 1.4280 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 0.7660 0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 0.6400 -0.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -0.4220 -1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 -0.8060 -2.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 -1.9120 -3.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 -2.6450 -3.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 -2.2720 -2.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4600 -1.1600 -1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4610 -0.7160 -0.5710 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7060 -1.4160 -0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6860 -0.6850 0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0670 0.5450 -0.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0240 1.2710 0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3040 2.5740 -0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9870 3.3660 -2.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8640 1.7630 -2.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7590 0.8450 -3.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6460 -0.0290 -3.1460 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6550 -0.6640 -3.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 3.4570 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 3.2590 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 2.6760 1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 1.6120 -1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -0.2100 0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 1.3880 0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 0.5840 1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -0.2760 -2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -2.2040 -3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -3.5110 -3.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4730 -2.8740 -2.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1110 -1.4300 -1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5590 -2.4360 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5800 -1.3010 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2200 -0.4660 1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9370 0.6750 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6240 1.4880 1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1910 3.1030 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4290 3.2270 -0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9400 3.5610 -2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6030 4.2520 -2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0580 3.0430 -3.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5220 2.6220 -2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2290 1.1850 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6710 0.2510 -3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5990 1.4160 -4.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4810 2.2630 -1.7550 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.8660 1.4300 -1.9150 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 2 4 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 48 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END