PUBCHEM-ZINC00413814 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -1.6770 -2.6460 -1.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -1.6560 -0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 -1.6470 0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 -0.7860 1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 0.0900 0.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 0.0830 -0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -0.7630 -1.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -0.6700 -3.1250 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 -0.3040 -3.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -1.8700 -3.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 0.6460 -3.5990 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 2.0060 -3.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 3.0300 -4.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 2.8500 -4.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0740 3.9060 -4.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4390 3.7400 -5.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0490 2.5170 -4.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2940 1.4560 -4.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9180 1.6070 -4.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 0.4460 -3.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 1.0170 1.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 1.8550 1.0450 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.3960 -3.1320 -0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2680 -2.1580 -2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 -3.4370 -1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5920 -2.3220 1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -0.8060 2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 0.7520 -1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 2.1900 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8320 2.1110 -3.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 4.0380 -3.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 2.9290 -5.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6090 4.8640 -5.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0260 4.5650 -5.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1130 2.3890 -5.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7830 0.5070 -4.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 -0.4470 -4.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4310 0.3000 -2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 0.8890 2.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 2 0 0 0 0 M CHG 1 22 -1 M END