PUBCHEM-ZINC02933959 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 0.3090 2.1290 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 0.6950 -0.4040 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4510 0.7380 -1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 -0.3500 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 -0.0680 1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -1.0860 1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 -2.3680 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 -2.6900 0.2590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -1.6780 -0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3160 0.2780 -0.3320 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8790 0.1030 1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6520 1.3340 1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 0.9140 4.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3860 2.1060 3.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 0.0260 -1.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 0.3070 -3.0850 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3710 -0.4290 -1.2600 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1140 -1.4240 -1.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -2.3870 -2.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3250 -3.3630 -3.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7010 -3.3960 -3.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2890 -2.4420 -2.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4960 -1.4710 -1.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5440 -4.3000 -3.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1370 -5.6140 -3.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7430 -6.3080 -2.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3710 -7.6500 -2.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4090 -8.2960 -3.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8290 -7.6070 -5.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2020 -6.2660 -5.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 2.5000 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 2.8060 -0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 2.1990 1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 0.9390 1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5910 -0.8810 2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2590 -3.1940 1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -1.9820 -0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5380 -0.7730 1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -0.1370 1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 2.2050 1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4350 1.6130 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 1.8330 4.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 0.0500 3.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9700 0.7420 4.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1090 2.1100 2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8870 3.0740 3.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8870 1.8310 4.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8750 0.0170 -0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4630 -2.4240 -2.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8540 -4.0870 -4.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3630 -2.4560 -2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9800 -0.7410 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7260 -5.8170 -1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0530 -8.1920 -1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1190 -9.3410 -4.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8670 -8.1150 -6.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5350 -5.7310 -5.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 1.0550 2.8660 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.8530 0.1640 2.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 12 58 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 13 58 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 14 58 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 29 2 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END