PUBCHEM-ZINC05447545 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 0.3400 1.8570 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 0.3370 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -0.0690 1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 -0.2230 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9290 0.1410 1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2220 -0.3910 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6980 -1.2990 0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 -1.6710 -0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 -1.1370 -0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2150 -2.6560 -1.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 -3.1160 -2.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6500 -3.1220 -1.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5990 -2.1640 -1.2240 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4740 -1.1840 -1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1100 -1.9210 0.2490 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1240 -0.9790 0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5710 -1.4510 0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0080 -1.5880 -0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1070 -2.5370 -1.4200 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.4340 -4.0100 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6190 -2.2640 -2.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8800 -1.5250 -3.5970 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9370 -3.1950 1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 2.2330 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 2.1480 -1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 2.3690 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 -0.0860 -0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 0.3610 2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.1580 1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 0.2720 0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 0.8410 1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8430 -0.0840 1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 -1.4430 -1.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9260 -3.1870 -3.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6870 -4.1340 -1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8840 -0.8750 2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0560 0.0290 0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7110 -2.3990 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2200 -0.7230 1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0530 -1.9240 -0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0060 -0.5860 -1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0930 -4.3340 -0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5130 -4.2020 -1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9820 -4.6750 -1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4900 -2.9470 2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8800 -3.6910 1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2720 -3.9310 0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7260 -2.7930 -3.1940 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 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 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 M CHG 1 48 -1 M END