PUBCHEM-ZINC05624615 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 0.8210 1.2270 -0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -0.0090 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 -0.3100 1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 -1.5300 1.4390 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5760 -1.7950 2.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 -0.9760 3.5450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 -3.1080 2.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8510 -3.1620 4.6220 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6010 -4.7560 4.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6540 -5.6120 3.5770 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2910 -5.4520 2.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3220 -6.7500 3.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6760 -7.9400 3.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3570 -8.9060 4.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6910 -8.6950 5.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3470 -7.5190 6.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6570 -6.5310 5.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1860 -5.3010 5.6790 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.3150 -4.6780 6.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 -0.8780 -1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 -1.4610 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 -2.2720 -2.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -2.5130 -3.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -1.9350 -3.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -1.1160 -2.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 -2.1740 -4.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 -1.5490 -4.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3690 -3.3140 -4.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 0.9780 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 1.6160 -1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 1.9830 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 -2.1850 0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 -3.2060 2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 -3.9270 2.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4200 -8.1110 2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6320 -9.8330 3.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2250 -9.4590 5.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6100 -7.3620 7.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2420 -4.1070 7.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3300 -5.4530 7.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -4.0130 7.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 -1.2760 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 -2.7220 -2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 -0.6640 -2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 -1.8210 -4.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 -0.4670 -4.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 -1.8830 -3.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7650 -2.8430 -5.0620 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 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 1 0 0 0 0 10 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 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 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 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 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 44 1 0 0 0 0 26 27 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 M CHG 1 18 1 M END