PUBCHEM-ZINC04978815 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 -0.0670 -2.0060 -0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -0.8820 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -0.3400 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 -0.9200 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 -2.0600 -1.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 -2.5960 -1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 -2.3980 -1.3260 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9260 -3.1420 -1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4330 -1.4860 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 -0.6200 -0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9080 -1.4790 -0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6040 -0.5180 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0680 -0.5960 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8300 0.5750 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2040 0.4970 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8340 -0.7350 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0880 -1.9030 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7080 -1.8400 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7150 -3.1080 0.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1420 -3.1000 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6560 -4.5160 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9620 -5.1100 -1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4330 -6.4090 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5990 -7.1140 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2930 -6.5200 1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8260 -5.2190 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1020 -8.5050 0.0080 N 0 3 0 0 0 0 0 0 0 0 0 0 14.3710 -9.0290 -1.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2480 -9.1260 1.0460 O 0 5 0 0 0 0 0 0 0 0 0 0 6.6070 -2.4800 -1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1620 -3.2750 -2.0740 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 -2.4250 -1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -0.4300 0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 0.5360 0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -3.4710 -2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0790 0.3000 0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3420 1.5380 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7910 1.4000 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9110 -0.7890 0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1270 -2.7470 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5520 -2.5430 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4470 -2.6260 1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8320 -4.5590 -2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6720 -6.8730 -2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4220 -7.0710 2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5910 -4.7540 2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 30 31 3 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END