PUBCHEM-ZINC05998273 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3820 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -0.5120 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -2.0420 1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 -2.5600 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 -1.9610 -1.1860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -0.4990 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -2.9160 -2.4250 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -2.0980 -3.5870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 -4.1350 -2.3390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 -3.3110 -2.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 -2.4880 -2.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7130 -2.7920 -2.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0320 -3.9180 -1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0170 -4.7510 -1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 -4.4430 -1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3520 -5.9600 -0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5940 -6.3790 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4890 -7.5220 0.7590 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.4350 -8.2960 1.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1120 -9.4220 1.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7730 -9.7800 2.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 -8.9740 1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1960 -7.8330 0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 -6.8720 0.2260 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 -6.8420 0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3620 -10.4070 2.6910 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 -0.1540 1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -0.1410 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -2.4030 2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -2.4010 1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -2.2780 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -3.6450 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -0.2240 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -0.0490 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1450 -1.6050 -3.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4970 -2.1450 -2.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0660 -4.1530 -1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -5.0860 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5170 -5.8830 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4740 -8.0220 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4980 -10.6700 2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -9.2240 1.6830 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 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 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 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 44 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 45 1 0 0 0 0 22 23 1 0 0 0 0 22 28 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 M CHG 1 20 1 M END