PUBCHEM-ZINC03678676 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.7280 2.2770 1.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 0.7610 1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 0.1080 1.4080 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7650 -1.2500 1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 -1.9420 1.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 -3.3230 1.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -4.0160 1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9180 -3.3300 1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9190 -1.9480 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1720 -1.2000 0.7320 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9140 -0.3470 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8710 -0.7190 1.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2080 -0.8130 2.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5060 -0.2560 3.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6970 -0.0890 4.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6030 0.4930 5.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3900 0.8990 5.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 0.7450 5.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2600 0.1570 4.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2970 -0.1380 3.0800 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3490 0.0370 3.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1450 -1.4020 1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3980 -1.4750 -0.2030 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.9760 -2.0710 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2140 -0.0830 -0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1370 0.2610 -1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2480 0.7740 -0.7690 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9980 2.0970 -1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 -5.5230 1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 -4.0740 2.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 2.7740 1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 2.5530 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 2.5830 2.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 0.4540 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 0.4850 2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -1.4000 2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8150 -3.8740 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6480 -0.4020 3.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5030 0.6390 5.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3760 1.3510 6.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2570 1.0660 5.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4470 -2.4030 1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0250 -0.7660 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2190 2.5880 -0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6730 2.0080 -2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9130 2.6870 -1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0660 -5.8690 2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 -5.8980 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 -5.8920 1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 -4.2380 3.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -5.0360 1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 -3.4930 1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0810 -2.0960 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6750 -2.3850 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 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 36 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 53 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 53 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 53 54 1 0 0 0 0 M END