PUBCHEM-ZINC04533930 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.5950 1.1370 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 0.1340 0.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 -0.4890 -1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9180 -1.4430 -0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5870 -2.1530 -1.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2980 -1.9060 -3.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -0.9660 -3.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -0.2580 -2.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0260 -2.6800 -4.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 -3.8350 -3.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2990 -1.9730 -5.2400 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 -2.4820 -6.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1010 -1.6020 -7.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6710 -2.1260 -8.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0610 -3.3970 -8.8230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8100 -4.1510 -7.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 -3.7780 -6.5560 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7400 -1.0690 -9.5030 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2430 0.0300 -8.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8400 -0.2560 -7.6240 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2460 -1.0910 -10.8660 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7480 -2.0550 -11.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1790 -0.7760 -11.9520 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5280 0.0240 -11.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0650 -0.1290 -13.0290 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5090 0.5110 -13.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0780 0.6510 -12.2070 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6600 1.6190 -11.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2810 -0.0760 -10.9710 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4290 0.8470 -12.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2610 1.6560 -12.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1960 1.2500 -11.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6830 -1.1680 -13.7970 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0130 -1.8890 -13.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6610 -1.8920 -12.4520 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1570 1.9590 -0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 0.7120 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 1.5470 0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1520 -1.6350 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3340 -2.8950 -1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -0.7870 -4.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 0.4610 -2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -0.9840 -5.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0910 -5.1970 -7.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1990 1.0060 -9.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9520 -0.1030 -13.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3230 1.3530 -13.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 29 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 35 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 33 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 30 31 1 0 0 0 0 30 46 1 0 0 0 0 30 47 1 0 0 0 0 31 32 1 0 0 0 0 33 34 1 0 0 0 0 M CHG 1 35 -1 M END