PUBCHEM-ZINC02158582 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 -1.4860 -2.7490 2.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 -3.0470 1.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -2.7210 0.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 -2.9260 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 -3.3630 0.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7050 -2.6100 -1.6070 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0000 -1.8620 -1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 -3.8850 -2.4470 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7400 -3.6480 -3.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 -4.8980 -1.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9950 -4.2890 -2.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1800 -2.9490 -1.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1100 -2.0790 -1.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3140 -0.8860 -1.6210 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 -5.1240 -2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1530 -5.3310 -1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1000 -6.1940 -1.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8460 -6.6800 -3.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3710 -6.0730 -3.7930 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -4.4650 -2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 -4.3580 -3.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -4.8900 -3.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 -5.5290 -1.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -5.6370 -0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 -5.1090 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6920 -6.0980 -1.7790 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.5110 -6.0030 -2.6760 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9890 -6.6610 -0.7410 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.6940 -1.6910 1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -3.3490 1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 -2.9930 3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 -2.4460 2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -4.1040 1.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 -5.1650 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -5.7920 -2.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1780 -2.5450 -2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2240 -4.8610 -0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9850 -6.4620 -1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4880 -7.3690 -3.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -3.8590 -4.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7260 -4.8060 -3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6710 -6.1360 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -5.1960 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 13 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END