PUBCHEM-ZINC01323654 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 -0.1130 0.2450 1.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -0.9640 0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -1.3020 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 -0.4370 0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 0.7810 1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 1.1160 1.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 -0.8270 -0.1000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7850 -1.8790 -0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1540 0.0420 -1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2540 -0.5550 -2.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5200 -1.7550 -2.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0030 0.3330 -3.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2120 -0.1330 -3.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9420 0.6600 -4.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4680 1.9210 -4.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2640 2.3880 -4.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5290 1.5960 -3.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1860 -0.6870 1.1380 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5440 -1.6440 2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1560 -2.9770 2.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 -3.7810 3.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 -3.2720 4.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0390 -1.9600 4.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4940 -1.1310 3.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9190 0.2650 4.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2870 1.2290 3.6500 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0990 0.5050 1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 -1.6470 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -2.2530 -0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 1.4720 1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 2.0520 2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2710 0.1250 -1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4290 1.0540 -1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5920 -1.1140 -3.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8800 0.2940 -4.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0360 2.5390 -5.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8940 3.3700 -4.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5900 1.9870 -3.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 -3.4130 1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3970 -4.8070 3.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2860 -3.8930 5.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0070 -1.5690 5.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8490 0.3630 5.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 18 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 2 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 43 2 0 0 0 0 M CHG 1 26 -1 M END