PUBCHEM-ZINC05454678 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 50 0 0 1 0 0 0 0 0999 V2000 0.2990 1.1690 0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -0.3470 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 -1.1540 0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -0.9490 -1.1510 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2820 -1.8060 -1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -0.0030 -2.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 1.1870 -1.8990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 -0.4790 -3.2730 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 0.4080 -4.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9150 -0.0560 -5.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5690 0.8800 -6.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9860 0.3910 -6.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6500 1.3410 -7.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0680 0.8520 -7.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8550 1.9780 -9.1820 S 0 0 0 0 0 0 0 0 0 0 0 0 9.4980 1.2450 -9.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3000 2.0920 -10.4020 C 0 0 3 0 0 0 0 0 0 0 0 0 10.4060 3.1040 -10.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6650 1.4830 -10.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8930 0.8040 -11.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 1.8530 -3.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 2.5680 -4.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -0.9950 0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 1.4650 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 1.6680 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 1.4550 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 -0.6060 0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 -2.1480 0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -1.4360 -3.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7990 -1.1020 -5.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9870 0.9020 -7.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 1.8820 -5.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5680 0.3680 -5.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9420 -0.6110 -7.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0680 1.3640 -8.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6950 2.3430 -7.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6500 0.8300 -7.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0230 -0.1500 -8.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0190 1.2120 -8.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3920 0.2330 -9.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0750 2.7420 -12.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 -0.9400 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -2.0390 0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 -0.4670 1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6280 1.6940 -9.6830 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5980 2.1360 -11.6920 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4880 1.2100 -12.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6100 2.3820 -3.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 3.3350 -3.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4880 1.2830 -9.8490 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 4 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 46 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 41 46 1 0 0 0 0 45 50 1 0 0 0 0 46 47 1 0 0 0 0 48 49 1 0 0 0 0 M END