PUBCHEM-ZINC06202179 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 72 0 0 1 0 0 0 0 0999 V2000 0.4390 1.5570 0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 0.0390 0.0910 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7030 -0.2940 -0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -0.6440 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -2.1620 1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 -2.6960 0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -1.9550 0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2820 -0.4360 0.0230 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2970 0.3260 0.9760 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7940 1.1010 0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3360 -0.6200 1.5950 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8380 -1.1870 2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8830 -1.6030 0.5920 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3100 -1.1090 -0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7880 -2.5820 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9680 -2.2150 1.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4780 -1.3020 2.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4910 -1.4840 2.8400 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5970 -0.0670 2.2440 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3670 0.1590 3.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2270 1.1360 1.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0980 2.6470 1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4550 3.1380 1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7410 2.4980 4.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3960 2.0320 3.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5840 4.2120 3.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2070 5.1820 4.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0950 5.9660 4.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6570 6.8880 5.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5550 7.7540 4.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0830 8.5160 3.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5490 7.8790 3.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 1.0070 2.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2490 0.3500 2.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 -0.2010 -1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 1.7890 -0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 2.0820 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 1.9830 1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 -0.3070 1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 -0.3670 2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 -2.4700 0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 -2.6170 1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 -3.7600 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9520 -2.8700 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8630 -3.5060 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5200 1.9750 1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3920 0.8700 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2510 2.2690 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4100 3.5000 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8050 3.9910 1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2100 2.3440 1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4750 1.6850 4.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5990 2.8950 5.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6630 2.8450 3.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0510 1.2120 4.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2540 3.4110 4.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0460 4.7720 2.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0560 5.8330 5.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9180 4.6370 5.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5040 7.5140 5.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2790 6.3300 6.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1570 8.4470 5.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7390 7.1390 4.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 -0.7900 -2.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 -0.4700 -1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6290 0.8520 -1.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5130 1.5840 2.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3130 3.6040 3.2140 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.6430 4.3950 3.2320 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 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 2 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 67 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 22 67 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 68 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 68 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 25 67 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 26 68 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 28 29 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 62 1 0 0 0 0 30 63 1 0 0 0 0 31 32 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 68 69 1 0 0 0 0 M CHG 1 68 1 M END