PUBCHEM-ZINC01149736 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 0 0 0 0 0 0999 V2000 -0.5590 0.9440 -0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 -0.5610 -0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -0.8090 1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 -1.2430 -0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -1.1110 -1.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 -0.6900 -1.0340 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9130 -1.2660 -2.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 0.7020 -0.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 -1.5030 0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 -2.8480 0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5040 -3.4880 1.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6240 -2.7800 2.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 -1.4290 2.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8710 -0.7930 1.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0660 -3.4250 3.8790 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9810 -4.4110 3.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4850 -4.6820 2.7220 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3700 -5.1640 5.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3170 -6.1870 4.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6760 -6.8860 6.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0990 -6.5760 7.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1600 -5.5640 7.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7970 -4.8530 6.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4890 -7.3300 8.4850 N 0 3 0 0 0 0 0 0 0 0 0 0 7.3150 -8.2220 8.4080 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9830 -7.0600 9.5600 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3540 1.4450 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 1.1270 -1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 1.3320 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 -0.6530 1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -1.8340 1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -0.1180 1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 -1.0660 -1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 -2.3150 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5350 -0.8340 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 -1.7220 -1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9730 -3.3990 -0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7520 -4.5390 1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3950 -0.8750 3.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 0.2580 1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 -3.1620 4.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7670 -6.4300 3.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4080 -7.6770 5.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7130 -5.3280 8.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0670 -4.0600 6.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END