PUBCHEM-ZINC06251339 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 0 0 0 0 0 0999 V2000 -0.0080 1.3730 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -0.0080 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -0.6810 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 0.0380 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 1.4190 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 2.0860 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 3.5920 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 4.0930 1.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 5.5620 1.4750 N 0 3 0 0 0 0 0 0 0 0 0 0 1.5340 6.0410 2.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 7.5700 2.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 8.1250 2.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 7.5600 0.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 6.0310 0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 6.0750 0.6150 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2370 -2.0800 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -2.7680 -0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 -2.1770 -1.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -4.2720 -0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -4.8000 -1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -6.3270 -0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 -6.8480 -1.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2400 -6.0760 -2.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 1.8970 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -0.5640 0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3210 -0.4830 -0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2720 1.9780 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 3.9760 -0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 3.9420 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 3.7100 2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 3.7430 1.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 5.7040 3.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 5.6420 3.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 7.9230 3.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 7.9080 2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 7.8300 2.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 9.2130 2.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 7.9070 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 7.8980 0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 5.6260 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 5.6950 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -2.5540 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -4.6840 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -4.5710 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9890 -4.3880 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -4.5010 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 -6.7390 -1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 -6.6260 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6750 -8.1680 -1.5780 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -8.4540 -1.9810 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 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 13 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 9 1 M CHG 1 15 -1 M END