PUBCHEM-ZINC05751221 MOE2007 3D CORINA 3.40 0006 02.08.2006 70 73 0 0 1 0 0 0 0 0999 V2000 2.2220 0.3020 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -0.0510 0.3680 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3030 0.8410 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -1.1960 1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 -0.7590 2.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -1.8240 3.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -3.0040 2.7020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 -0.3450 -1.1340 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2280 0.2240 -1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 -1.8210 -1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 -2.0610 -2.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -1.5730 -3.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -0.0980 -3.6430 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8020 0.4370 -3.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 0.1960 -2.2090 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1220 1.7460 -2.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 2.5680 -3.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 1.8100 -4.4100 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6740 1.4640 -3.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 0.5360 -4.8270 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8190 0.8450 -5.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.3950 -5.6320 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5230 -1.0220 -4.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 0.3800 -6.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 1.7480 -6.9100 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2650 1.5390 -7.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2170 2.6660 -5.6470 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2710 3.8340 -6.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 4.5930 -7.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 3.6850 -8.4700 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1310 3.3320 -8.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9270 2.4620 -8.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 4.4410 -9.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 4.7560 -9.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 3.2640 -5.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 -1.2840 -6.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -0.7470 -7.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -0.4800 -2.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -0.5550 1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 1.1250 0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 0.6340 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -1.5840 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -2.0340 1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 -0.4580 3.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 0.1130 2.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 -2.1230 -0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 -2.4830 -1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1540 -1.5470 -2.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 -3.1300 -2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 -1.7040 -4.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -2.2080 -3.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 1.9620 -1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 2.1540 -1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 3.5160 -3.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 2.8200 -3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 -0.1950 -7.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 0.5090 -6.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 4.5530 -5.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 3.4450 -6.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 5.2180 -7.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 5.3090 -7.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 1.7910 -8.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 2.7450 -7.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5130 3.8940 -4.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0430 3.8870 -6.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3320 2.4790 -5.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 -0.1900 -1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -0.2070 -2.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 -1.5710 -2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 -1.3780 4.1060 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 6 7 2 0 0 0 0 6 70 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 1 0 0 0 0 10 46 1 0 0 0 0 10 47 1 0 0 0 0 11 12 1 0 0 0 0 11 48 1 0 0 0 0 11 49 1 0 0 0 0 12 13 1 0 0 0 0 12 50 1 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 52 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 54 1 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 27 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 36 1 0 0 0 0 24 25 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 32 1 0 0 0 0 27 28 1 0 0 0 0 27 35 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 30 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 33 34 1 0 0 0 0 35 64 1 0 0 0 0 35 65 1 0 0 0 0 35 66 1 0 0 0 0 36 37 1 0 0 0 0 38 67 1 0 0 0 0 38 68 1 0 0 0 0 38 69 1 0 0 0 0 M CHG 1 70 -1 M END