PUBCHEM-ZINC05419635 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 1.9550 0.9890 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -0.3150 -0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -0.8800 0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 -2.0940 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -2.7420 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -2.1840 -1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -0.9760 -1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -0.4640 -2.6790 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -2.6380 2.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 -1.8420 3.5060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -4.0170 2.6680 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 -4.8000 3.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 -4.2780 5.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -5.1260 6.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 -6.5200 6.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -7.0510 4.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -6.1860 3.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -8.4350 4.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -9.2830 5.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -8.7830 7.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -7.4060 7.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -6.8940 8.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 -11.0540 5.4720 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 -11.6210 6.8160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -11.3370 4.6210 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7730 0.8640 -1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 1.7550 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 1.3560 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 -0.3700 1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 -3.6610 0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -2.7000 -1.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 0.4060 -2.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -0.9560 -3.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -4.5380 1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 -3.2140 5.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -4.6870 7.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -6.6130 2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -8.8710 3.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -9.4620 7.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -7.6280 9.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 -11.1150 4.8180 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 21 2 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 41 1 0 0 0 0 M CHG 1 41 -1 M END