PUBCHEM-ZINC05976917 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -0.4680 0.5030 -0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -0.7370 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -1.2050 -1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -0.4880 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -0.1430 2.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -0.0560 3.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 0.2630 4.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 0.3780 5.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 0.7000 7.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 0.8980 7.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 0.7950 6.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.4750 4.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4480 1.2360 8.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 1.7750 9.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7490 0.8660 8.8050 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 1.1740 10.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8060 1.1940 10.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3040 2.4820 9.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4560 3.7090 9.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 4.4120 10.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1380 5.4430 10.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 6.1070 10.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 5.4490 8.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 4.3770 8.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4400 4.1590 7.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9130 5.0090 6.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 6.0670 6.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 6.3080 7.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6130 0.1170 10.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9560 -0.4990 9.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 1.3580 -0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 0.3160 -1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 0.7850 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 -1.5400 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0410 -0.4410 -1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -2.1180 -0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -1.4260 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 -1.3820 1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 0.3130 1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 0.8200 2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -0.9340 2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 0.2170 5.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 0.7880 7.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8120 0.9780 6.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8780 0.4030 4.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2940 0.3020 8.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0040 2.4290 9.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9290 2.6130 10.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 4.2470 11.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0850 3.3340 6.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1540 4.8380 5.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 6.7150 5.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1010 7.1290 8.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0340 -0.0010 11.4390 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 29 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 2 0 0 0 0 29 54 1 0 0 0 0 M CHG 1 54 -1 M END