PUBCHEM-ZINC00255068 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.4600 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -0.7940 1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -2.1020 0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -2.0150 -0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 -0.7380 -1.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 -3.1560 -1.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 -2.9230 -3.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 -3.9880 -3.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 -5.2840 -3.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -5.5220 -2.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -4.4640 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -6.4230 -4.3850 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4740 -6.2160 -5.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 -7.5650 -3.9670 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2510 -0.3410 2.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 0.8440 2.7700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -1.2380 3.4890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 -0.8020 4.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 -1.7820 5.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 -1.3260 7.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -1.2860 7.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.3060 6.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 -0.7620 5.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8360 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 1.8220 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 1.8130 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 -2.9990 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -1.9110 -3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 -3.8080 -4.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -6.5360 -1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -4.6500 -0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -2.1730 3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 0.1940 4.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -2.7770 5.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -1.8100 5.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 -2.0240 7.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7750 -0.3300 7.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 -2.2820 7.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -0.9620 8.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 -0.2780 7.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 0.6890 6.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 -0.0640 4.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -1.7570 5.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 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 33 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 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 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M END