PUBCHEM-ZINC06190597 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 60 0 0 1 0 0 0 0 0999 V2000 -0.7120 -0.2320 -0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -0.8650 -1.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1430 -0.6000 -2.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -0.2610 -2.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 -0.7570 -1.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 -1.7760 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 -2.1800 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7740 -1.5670 -0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6570 -0.5480 -1.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 -0.1470 -2.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0970 -1.9840 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5650 -1.7950 1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9490 -2.3260 1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2530 -3.4780 1.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8220 -1.3730 1.7620 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2610 -1.5500 1.9900 C 0 0 3 0 0 0 0 0 0 0 0 0 10.6540 -2.2090 1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5720 -2.1150 3.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0800 -3.5490 3.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6920 -4.2420 5.1440 S 0 0 0 0 0 0 0 0 0 0 0 0 9.8260 -5.8270 5.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9900 -0.1730 1.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2150 0.8290 2.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8600 -1.0980 2.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1320 -1.0460 3.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0080 -1.6630 3.9800 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2540 -0.1470 4.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8300 0.5920 5.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0420 1.4580 5.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 1.5800 5.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 0.8300 4.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8830 -0.0390 3.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 -0.4030 0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 0.8540 -0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6930 -0.6400 -0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -1.9530 -1.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 0.4750 -3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 -1.0350 -3.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -1.0300 -2.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 -2.2790 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 -2.9820 0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5410 -0.0570 -1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 0.6490 -2.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7040 -2.4950 -0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5040 -0.4250 1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6580 -2.0850 3.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1210 -1.4720 4.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9880 -3.5810 3.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4390 -4.1840 2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0830 -6.4120 5.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7440 -5.6710 5.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1250 -6.3920 4.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0570 -0.5820 1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8930 0.5020 5.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4950 2.0380 6.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 2.2550 6.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 0.9180 4.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4040 -0.6340 3.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2400 -0.2190 1.7560 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 2 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 22 59 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 2 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 32 58 1 0 0 0 0 M CHG 1 59 -1 M END