PUBCHEM-ZINC06379862 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 5.3690 -0.1690 2.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2990 -1.5760 1.9820 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 -1.3900 0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6270 -0.3320 -0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4240 -0.1890 -1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 -1.0970 -2.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0510 -2.1540 -1.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2550 -2.3100 -0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6660 -3.3850 0.2350 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 -4.5070 -0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -4.6260 -1.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 -5.6140 0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 -6.6880 -0.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -7.7650 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 -7.7910 0.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -8.9020 -1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -9.9210 -0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 -9.8000 0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 -8.6590 0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5180 -8.5530 2.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 -9.5720 3.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 -10.7040 2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -10.8280 1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 -12.0420 1.3290 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2330 -12.9760 2.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -12.1080 0.3230 O 0 5 0 0 0 0 0 0 0 0 0 0 6.2950 -0.2390 1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8580 0.7610 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5970 -0.1820 3.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2400 0.3800 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8800 0.6360 -2.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4820 -0.9800 -3.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -2.8610 -2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 -3.3210 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 -5.9740 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -5.2360 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -8.9260 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -10.8250 -1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 -7.8630 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1080 -7.6730 2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9860 -9.4840 3.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6450 -11.4950 3.5280 H 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 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 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 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