PUBCHEM-ZINC05387013 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 66 0 0 1 0 0 0 0 0999 V2000 -0.1290 1.5960 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 0.0730 -0.1480 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9070 -0.3020 0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 0.4300 0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8340 0.0760 -0.6140 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1190 -0.9760 -0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 0.3240 -1.7570 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5970 1.3850 -1.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -0.5030 -1.4520 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8440 -1.5550 -1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -0.3350 -2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 -0.7550 -1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -0.5400 -0.1130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4020 -1.4930 0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 0.4060 0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0330 1.1780 -0.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5560 0.3870 2.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5470 1.3910 2.4410 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2880 2.6720 2.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4780 3.2450 3.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4370 2.3390 2.8720 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8880 1.2280 2.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6130 -0.0070 2.0920 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.9940 -0.9900 1.7260 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8290 -0.0410 2.1510 O 0 5 0 0 0 0 0 0 0 0 0 0 2.4680 -0.1440 -3.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 0.7330 -3.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6340 0.6940 -2.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9220 0.4580 -2.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8900 0.4260 -1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9570 -0.1410 -1.4600 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4850 1.1400 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0790 0.6630 0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0850 0.9310 -0.8500 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6730 2.4020 -0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 2.0190 -0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 1.8600 -1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 1.9940 0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 0.0140 1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 -1.3790 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0630 1.5050 0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9430 0.1540 1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 0.7030 -2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 -0.9960 -3.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6620 -0.1320 -1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0400 -1.8050 -1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8940 -0.6000 2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 0.6130 2.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3160 3.1340 2.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6320 4.2570 3.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -1.1830 -2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7370 -0.0570 -3.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1860 0.3520 -4.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 1.7590 -3.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2530 0.2900 -3.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1800 0.8890 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4800 2.2170 -0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1080 -0.4080 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7500 1.1820 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 2.6080 0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5460 3.0340 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 2.6130 -1.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 26 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 27 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 34 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 33 34 1 0 0 0 0 33 58 1 0 0 0 0 33 59 1 0 0 0 0 34 35 1 0 0 0 0 35 60 1 0 0 0 0 35 61 1 0 0 0 0 35 62 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END