PUBCHEM-ZINC05139074 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 40 0 0 1 0 0 0 0 0999 V2000 -1.0040 1.0620 0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -0.4510 0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -0.8320 1.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -2.3450 1.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -2.7270 2.9710 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6940 -2.1470 3.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -2.4300 4.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -3.2520 3.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -4.2190 2.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 -4.5580 4.1710 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 -5.8880 4.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -6.8870 3.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 -8.2010 3.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8650 -8.5230 4.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2200 -7.5300 5.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 -6.2140 5.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2820 -5.1520 6.5510 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6430 -4.0630 6.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2380 -5.3660 7.7500 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0460 1.5750 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 1.3340 -0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6490 1.3550 1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 -0.9640 0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -0.7430 -0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -0.3190 1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -0.5400 2.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 -2.8580 1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 -2.6380 0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -2.6950 5.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 -1.3690 4.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -2.9840 3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -4.3140 3.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1370 -3.0450 4.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -4.8010 2.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7220 -4.4470 2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1370 -3.8580 4.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 -6.6360 2.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 -8.9780 3.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 -9.5510 5.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7540 -7.7850 6.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 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 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END