PUBCHEM-ZINC05966541 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 0 0 0 0 0 0999 V2000 0.0630 -1.0390 -2.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 -0.9110 -1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 0.7210 0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4290 0.8620 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 0.5020 -0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 1.9700 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1250 2.0700 -0.0820 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 3.3080 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0530 4.5050 0.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 4.6320 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9800 5.4840 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2120 4.8520 0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9960 3.5170 0.2760 N 0 3 0 0 0 0 0 0 0 0 0 0 6.0310 2.4800 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5590 2.2490 -1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5590 1.0410 -1.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1590 -0.1360 -0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0200 0.7970 -3.2460 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.4010 5.6740 0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5040 5.1640 0.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2500 7.0120 0.7380 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0350 7.5790 0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9420 8.7870 0.7440 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9190 6.8550 0.4480 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 7.5330 0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4270 7.8580 0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -0.9060 -2.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -2.0270 -3.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 -0.2760 -3.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 -1.0260 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -1.6850 -0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 1.6560 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -0.0840 1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5280 1.6680 -0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7750 -0.0720 -0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0310 1.0920 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 0.0710 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -0.0450 0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 2.5360 -1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.3760 0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 1.2680 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8450 2.8020 0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6030 1.5540 0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9370 3.0790 -1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0750 -0.2480 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6250 -1.0420 -1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4880 0.0300 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 7.6080 1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7650 8.5320 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9610 6.9620 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8390 8.1600 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1380 8.7440 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1780 7.2990 1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 0.4120 -0.7490 N 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 30 1 0 0 0 0 2 31 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 54 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 M CHG 1 13 1 M END