PUBCHEM-ZINC05852384 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 0 0 0 0 0 0999 V2000 -0.0100 1.0350 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 2.9830 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 3.4450 2.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 4.9740 2.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 5.4350 3.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 6.9640 3.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9810 7.4260 5.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 8.8940 5.2110 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8420 9.4290 4.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4640 9.3510 6.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7260 8.9950 6.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1740 9.4500 8.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3350 10.2700 8.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0650 10.6210 8.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6350 10.1620 7.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 10.4960 6.7800 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.8240 10.7450 10.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1390 11.4580 10.9250 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1750 10.3240 10.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9060 9.5170 9.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4280 9.1050 8.5900 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2720 8.2500 7.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6710 8.7620 7.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5020 7.6150 8.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7350 10.7550 11.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8510 10.4020 12.2330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.0550 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 1.4090 0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 1.3950 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 3.3570 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 3.3700 1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 3.0570 2.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 3.0710 3.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 5.3610 2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0230 5.3470 1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2390 5.0480 3.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6920 5.0620 4.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 7.3520 3.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7840 7.3380 3.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0000 7.0380 5.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 7.0520 6.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8600 9.0530 4.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8500 10.5170 4.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4280 9.1130 3.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3580 8.3650 6.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 11.2510 9.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8970 9.2080 10.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7460 7.6680 6.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9640 9.7340 7.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0660 8.5160 6.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7860 6.6150 8.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6840 7.8330 9.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5150 1.2620 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6310 1.1300 1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0100 11.5430 12.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4210 11.8010 13.5640 H 0 0 0 0 0 0 0 0 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 1 53 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 53 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 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 26 2 0 0 0 0 25 55 1 0 0 0 0 53 54 1 0 0 0 0 55 56 1 0 0 0 0 M END