PUBCHEM-ZINC06303462 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.3800 3.0000 0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 1.8010 0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 1.0240 1.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 1.0080 2.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 0.1120 3.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -0.3880 3.5200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 0.1990 2.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 -0.3090 4.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 0.6370 5.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 0.1410 6.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4100 -0.7840 6.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 0.8610 7.6890 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8280 1.9740 7.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2800 1.6660 7.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4970 0.2320 8.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4530 -0.1770 9.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 -0.1130 8.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1610 -0.8310 9.2530 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3980 3.1320 7.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3560 4.2450 7.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5950 5.5750 6.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5300 6.3110 7.9460 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 1.8090 1.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4880 1.7990 1.9950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 2.6050 0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 3.4930 -0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 3.7370 1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 2.1540 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 1.1720 -0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 -1.3270 4.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 -0.3730 3.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 1.6390 5.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 0.7110 5.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8950 1.8700 7.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6020 2.3410 8.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4650 -0.4440 7.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4990 0.1370 8.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6440 -1.2050 9.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4850 0.4790 10.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8390 1.3280 7.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9770 4.3390 8.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0090 4.0890 6.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0710 1.9890 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4830 3.5110 0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1700 5.7970 5.7460 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 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 17 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 19 2 0 0 0 0 14 15 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 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M CHG 1 45 -1 M END