PUBCHEM-ZINC06489042 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 62 0 0 1 0 0 0 0 0999 V2000 -0.1990 2.4850 -0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 1.0190 -0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 0.3180 -1.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.9970 -1.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 -1.6210 -0.8300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 -1.5680 -2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 -2.8020 -2.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 -3.3730 -3.1530 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 -2.6530 -4.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -1.3870 -4.4380 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 -0.7670 -5.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 0.3300 -5.9530 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8350 -1.6500 -6.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7160 -1.4010 -7.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9070 -0.1410 -7.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3800 0.1340 -9.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3790 1.5430 -9.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9210 2.0770 -8.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6960 1.0660 -7.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6240 3.4200 -7.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9160 4.5500 -8.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5910 5.8290 -7.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9770 6.0020 -6.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 4.8920 -5.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0100 3.6110 -6.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 4.9930 -4.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5690 5.8370 -3.5990 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5510 7.6180 -6.1240 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.7710 -3.2090 -5.3600 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -0.7340 -3.6160 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6620 0.2200 -3.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -0.4510 -4.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 0.8800 -4.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 1.1660 -5.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 0.1230 -5.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0200 -1.2040 -5.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 -1.4910 -4.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8280 0.4760 -6.7400 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -3.6560 -1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 2.6140 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 2.8900 -1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 3.0670 0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 0.6170 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6250 0.9050 -0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3640 -2.2030 -7.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6670 -0.6040 -9.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6580 2.0890 -10.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3890 4.4580 -9.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8120 6.6910 -8.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7570 2.7480 -5.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 1.7090 -4.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 2.2020 -5.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 -2.0180 -6.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 -2.5310 -4.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -4.2850 -1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0610 -4.3160 -0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -3.0640 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 4.1940 -4.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 43 1 0 0 0 0 2 44 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 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 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 46 1 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 20 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 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 58 2 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 51 1 0 0 0 0 34 35 1 0 0 0 0 34 52 1 0 0 0 0 35 36 2 0 0 0 0 35 38 1 0 0 0 0 36 37 1 0 0 0 0 36 53 1 0 0 0 0 37 54 1 0 0 0 0 39 55 1 0 0 0 0 39 56 1 0 0 0 0 39 57 1 0 0 0 0 M CHG 1 27 -1 M END