PUBCHEM-ZINC00511860 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 0.3550 1.5640 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 0.0340 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -0.4850 -1.3350 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4840 -0.0470 -2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 -0.0960 -1.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -1.9860 -1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -2.5840 -2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -3.9590 -2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -4.7410 -1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3110 -4.1380 -0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -2.7620 -0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -6.0940 -1.5400 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 -6.7250 -2.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 -6.0960 -3.3040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 -8.1800 -2.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -9.0580 -1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 -10.4160 -1.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -10.9090 -3.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 -10.0450 -4.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -8.6840 -3.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -7.7610 -5.0750 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0170 -8.2060 -6.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 -6.5570 -4.8920 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3850 1.9170 -0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 1.9320 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 1.9340 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 -0.3330 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 -0.3180 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9680 -0.5340 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9260 -0.4660 -2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 0.9900 -1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 -1.9750 -3.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -4.4260 -3.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 -4.7440 0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 -2.2930 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 -8.6740 -0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 -11.0950 -1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 -11.9730 -3.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -10.4370 -5.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END