PUBCHEM-ZINC01855948 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 -0.2030 1.6260 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 0.1110 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 -0.4690 1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 -1.9940 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 -2.5710 2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6760 -4.1180 2.3760 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6330 -4.4590 2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4270 -4.7200 1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 -6.2530 1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0390 -6.7970 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9810 -8.3150 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 -4.5910 3.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -5.2950 4.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9370 -5.7390 5.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2690 -5.4820 6.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0970 -4.7750 5.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 -4.3330 4.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9150 -6.0280 7.7490 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9250 -5.0190 8.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7360 -6.0010 8.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 2.0820 0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 2.0180 -0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 1.9370 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -0.3120 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 -0.1670 -0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 -0.0400 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -0.1840 2.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -2.4220 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 -2.2660 0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 -2.1790 2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -2.1980 3.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9870 -4.3380 0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4760 -4.4000 1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8520 -6.6820 1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 -6.5760 1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5510 -6.3880 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0870 -6.4760 -0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 -8.6690 -0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4690 -8.6820 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4910 -8.7580 0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 -5.5030 4.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -6.2810 6.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1300 -4.5690 5.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2430 -3.7850 3.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4280 -7.3560 7.4230 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 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 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 45 1 0 0 0 0 M CHG 1 45 -1 M END