PUBCHEM-ZINC02981785 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 -2.9680 -0.0730 2.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -0.0460 1.0800 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2700 0.7420 0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 0.3000 1.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -0.6460 2.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9570 -1.3530 0.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 -1.4400 -0.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4940 -0.7610 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 -0.9360 -2.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1420 -1.8000 -3.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0610 -2.5140 -2.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6880 -2.3320 -1.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 -1.9950 -4.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9090 -1.7260 -6.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6080 -2.0850 -7.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7720 -2.4730 -7.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -1.9660 -8.3950 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -1.5340 -8.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8640 -1.5920 -10.0430 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 -1.1090 -7.3170 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 -1.1080 -6.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -0.5880 -5.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -0.6120 -7.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 0.6790 -7.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 1.2070 -7.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9920 0.4520 -7.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7750 -0.8350 -6.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 -1.3760 -6.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -2.9950 -6.2720 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.1580 -1.7100 -6.2930 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.9880 0.8870 2.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9810 -0.2990 1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 -0.8550 2.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0850 -0.1030 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7270 -0.3940 -3.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 -3.2070 -3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 -2.8780 -1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5780 -2.4250 -4.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3110 -2.2420 -9.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 1.2850 -8.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 2.2080 -8.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9940 0.8750 -7.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 1.5220 1.5520 O 0 5 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 6 1 0 0 0 0 4 5 2 0 0 0 0 4 43 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 21 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 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 M CHG 1 43 -1 M END