PUBCHEM-ZINC03752649 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 1.3470 1.1830 2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 -0.3130 2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -0.7520 1.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -2.0780 1.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -2.4520 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 -3.7770 0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -4.7530 0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 -4.3750 1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -3.0480 1.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 -6.1440 0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -7.0360 -0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -8.2820 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -9.5430 -0.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7910 -10.5870 -0.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 -10.3700 0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 -9.1330 1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0780 -8.1120 0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 -6.8210 1.1850 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 -6.4210 1.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 -11.8570 -1.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 -12.2010 -1.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 -13.4030 -2.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -13.9370 -3.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -14.2870 -3.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 -13.1120 -2.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 -12.5830 -1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -6.7660 -1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 -7.4980 -0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7510 -6.9060 0.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 1.5720 2.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 1.7120 1.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 1.4080 3.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 -0.5060 1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 -0.8170 3.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -1.7030 1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 -4.0320 0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 -5.1170 1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9510 -2.8150 1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -9.6650 -1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4770 -11.1850 0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 -8.9810 1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -11.3900 -2.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5780 -14.2000 -2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 -13.1130 -3.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 -14.8250 -4.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -13.1840 -4.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 -15.1450 -2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 -14.5920 -3.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -13.4230 -1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9180 -12.3060 -2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 -11.7240 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 -13.3400 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 -7.0880 -2.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -5.6930 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -8.5940 -1.3840 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 27 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 39 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 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 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 29 2 0 0 0 0 28 55 1 0 0 0 0 M CHG 1 55 -1 M END