PUBCHEM-ZINC05887360 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 63 0 0 1 0 0 0 0 0999 V2000 -0.5160 2.0190 -0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 0.5340 -0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 0.3700 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 -0.2550 -0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -1.7870 -0.1920 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8060 -2.1130 0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8130 -2.4260 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 -2.9900 -0.9850 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3940 -2.2750 1.1970 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9010 -1.7840 1.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7430 -2.7600 1.4670 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9170 -3.6680 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9710 -3.0320 2.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2660 -4.3050 3.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6200 -4.6100 4.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9740 -5.9040 5.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7010 -1.6610 0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6280 -0.5130 1.4410 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7070 -2.0240 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -2.3120 -1.4370 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -2.4860 -2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 -2.5780 -1.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 -2.4730 -0.7290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 -3.0810 -3.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0980 -3.7390 -3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -1.9170 -3.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 -2.4030 -5.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -1.0670 -4.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 2.5940 -0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 2.1650 -1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 2.4390 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 0.1840 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -0.6670 1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 0.9790 1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 0.6830 1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1960 0.0830 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 0.0150 -1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6310 -2.1780 3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0470 -3.1320 3.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5670 -5.1490 2.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1800 -4.1920 3.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2960 -3.7780 5.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7100 -4.6850 4.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2920 -6.7620 4.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8820 -5.8400 5.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1990 -1.1120 -0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1930 -2.4830 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9370 -1.2570 -3.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 -3.1420 -5.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 -1.5690 -6.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 -2.8540 -5.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 -1.6830 -4.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 -0.5430 -3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -0.2980 -5.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3950 -6.1780 6.7590 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.9880 -7.0590 7.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4170 -6.2680 6.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0960 -5.4340 7.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1020 -3.9470 -2.8500 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4150 -4.3920 -3.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -4.6910 -2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 -3.3860 -2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9540 -3.1480 0.5990 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.7160 -3.2140 -0.5030 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 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 20 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 16 55 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 19 63 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 59 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 55 58 1 0 0 0 0 59 60 1 0 0 0 0 59 61 1 0 0 0 0 59 62 1 0 0 0 0 63 64 1 0 0 0 0 M CHG 1 55 1 M CHG 1 59 1 M END