PUBCHEM-ZINC06281854 MOE2007 3D CORINA 3.40 0006 02.08.2006 70 74 0 0 1 0 0 0 0 0999 V2000 2.6750 0.0420 0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 -1.3890 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 -2.3080 1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 -3.6080 0.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 -4.0350 -0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 -3.0980 -1.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 -1.7640 -1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -3.5260 -2.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -4.8350 -2.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -5.7120 -1.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 -7.0100 -2.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 -5.3060 -0.6570 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -7.5840 -2.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -5.3360 -4.2610 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6440 -6.0300 -4.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -6.0420 -4.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 -5.4810 -5.5570 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0780 -6.4170 -6.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5470 -7.5600 -5.7840 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 -7.3720 -5.1180 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -8.4090 -4.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 -8.7150 -5.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -9.7280 -5.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4200 -10.0900 -6.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 -3.4870 -4.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -4.4620 -4.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 -5.0130 -2.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5430 -5.9060 -2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4860 -6.2510 -3.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4180 -5.6970 -4.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4140 -4.7990 -5.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4760 -7.1300 -3.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4130 -7.4390 -4.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -4.6410 -6.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 -3.4460 -7.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -2.9640 -7.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 -1.8630 -8.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 -1.2860 -8.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 -1.7720 -8.3610 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 -2.8210 -7.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7400 0.1570 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 0.6980 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 0.3060 1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 -1.9850 1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 -4.3080 1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -1.0420 -2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 -2.8360 -3.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -9.3140 -4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -8.0590 -3.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -7.8110 -5.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -9.0660 -6.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9710 -10.4680 -7.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0480 -10.8620 -5.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0280 -9.2140 -6.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 -2.7200 -5.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 -3.0200 -3.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 -4.7440 -2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -6.3360 -1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1510 -5.9640 -5.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3620 -4.3640 -6.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1480 -8.1500 -3.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9190 -6.5260 -4.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8860 -7.8750 -5.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 -5.1300 -6.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -5.3420 -6.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 -3.4360 -7.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -1.4610 -9.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -0.4280 -9.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 -3.1930 -7.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -4.2010 -5.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 44 1 0 0 0 0 4 5 1 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 12 2 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 47 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 13 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 70 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 25 70 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 33 63 1 0 0 0 0 34 35 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 34 70 1 0 0 0 0 35 36 1 0 0 0 0 35 40 2 0 0 0 0 36 37 2 0 0 0 0 36 66 1 0 0 0 0 37 38 1 0 0 0 0 37 67 1 0 0 0 0 38 39 2 0 0 0 0 38 68 1 0 0 0 0 39 40 1 0 0 0 0 40 69 1 0 0 0 0 M END