PUBCHEM-ZINC04087059 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 30 0 0 0 0 0 0 0 0999 V2000 0.0040 1.5480 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 0.0180 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7230 -0.4740 1.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -1.8060 1.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 -2.5360 0.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 -2.3890 2.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5150 -3.8940 2.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5310 -4.5660 1.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5090 -5.9450 1.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 -6.6560 2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 -5.9770 2.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 -4.5980 3.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 -6.7300 3.5650 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6160 -6.1320 4.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 -7.9480 3.5890 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4380 -8.0500 2.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 -6.6640 1.0180 N 0 3 0 0 0 0 0 0 0 0 0 0 4.4660 -6.0390 0.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6240 -7.8820 1.0230 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0290 1.9200 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 1.9170 -0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 1.8960 0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 -0.3540 0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -0.3310 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5770 -2.0450 2.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 -2.0680 3.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3430 -4.0130 1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 -4.0700 3.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 -8.5530 2.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -8.5150 2.1290 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 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 6 26 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 27 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M CHG 1 17 1 M CHG 1 19 -1 M END