PUBCHEM-ZINC02193136 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 48 0 0 0 0 0 0 0 0999 V2000 1.1910 -0.3310 1.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -0.8630 0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 -1.5810 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -2.1150 -0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6600 -2.8310 -0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3510 -3.4500 -1.9280 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.9190 -4.0810 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0760 -3.3860 -1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3380 -3.8160 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4470 -4.9630 -0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2870 -5.6620 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0200 -5.2330 -0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8490 -5.8730 -0.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9160 -7.0200 0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8000 -5.4780 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5090 -6.1960 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6340 -7.3780 -1.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5210 -3.2100 -1.6300 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4490 -1.9920 -2.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 0.1790 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 0.3850 2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 -1.1450 2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -0.0290 -0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 -1.5500 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -2.4120 1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -0.8910 1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 -1.2790 -1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 -2.8040 -1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 -3.6670 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 -2.1400 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9620 -2.5090 -2.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3990 -6.5500 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3370 -6.7700 1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4790 -7.8260 0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8940 -7.3770 0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6850 -6.1600 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4070 -4.6430 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6700 -5.5460 -2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9540 -7.0860 -1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5930 -7.6590 -1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0710 -8.2680 -2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7840 -6.7050 -2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4700 -1.6230 -2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8890 -1.2290 -1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0230 -2.1590 -3.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8590 -6.6540 -0.7450 N 0 3 0 0 0 0 0 0 0 0 0 0 -10.7600 -7.2640 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4070 -5.8390 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 46 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 M CHG 1 46 1 M END