PUBCHEM-ZINC01175657 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 1.1810 1.9390 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 0.4230 -0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7230 -0.1880 -1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0300 -0.6040 -1.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 -1.1640 -2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1070 -1.3090 -3.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 -0.8930 -3.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -0.3370 -2.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8620 -1.9190 -4.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5610 -4.0290 -5.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4480 -5.5490 -5.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 -5.9280 -5.7140 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 -5.2160 -4.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 -3.7090 -5.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5580 -7.1230 -6.7580 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -6.9520 -6.9550 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4990 -7.1220 -7.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 -8.6580 -5.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9810 -8.6760 -4.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1380 -9.8810 -3.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0720 -11.0680 -4.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 -11.0510 -5.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -9.8460 -6.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 -9.8270 -8.0810 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5070 -10.8600 -8.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 -8.7780 -8.6410 O 0 5 0 0 0 0 0 0 0 0 0 0 2.2440 2.1560 -0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 2.3590 -1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 2.3800 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 0.0040 0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 0.2060 -0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 -0.4910 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7430 -1.4890 -2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -1.0060 -4.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -0.0150 -2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4950 -1.4990 -5.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9240 -1.7000 -4.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5870 -3.7180 -5.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2830 -3.7460 -6.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0270 -6.0410 -6.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8240 -5.8460 -4.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -5.4880 -5.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 -5.4810 -3.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -3.4300 -6.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 -3.1660 -4.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 -7.7490 -4.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 -9.8950 -2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1950 -12.0100 -4.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 -11.9780 -6.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 -3.3740 -4.7920 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 9 50 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 10 50 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 14 50 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 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 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END