PUBCHEM-ZINC06614745 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 1.3250 2.1130 -0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 0.6320 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5610 0.0310 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 -1.3340 1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -2.1220 0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -1.5440 -0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -0.1630 -1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 0.4400 -2.3410 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2900 1.4640 -2.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 0.5270 -2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 1.7300 -1.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6260 1.8260 -1.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4730 0.7350 -2.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8320 -0.4600 -2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 -0.5690 -2.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8560 0.8290 -2.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5000 2.0810 -1.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7170 -0.3200 -2.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 0.4020 -4.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 0.0780 -5.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 0.2700 -5.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 -0.3250 -3.6890 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4380 0.2460 -2.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 -1.7850 -3.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 -2.7080 -3.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 2.3110 -1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 2.6340 -0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 2.5440 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 0.6290 1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7540 -1.7790 2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -3.1880 0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -2.2000 -1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 2.6170 -1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0360 2.7900 -1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4110 -1.3530 -2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -1.5360 -2.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2710 2.8730 -2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5910 1.9890 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1790 2.3950 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4910 -1.1380 -1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7770 -0.0770 -2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5990 -0.6720 -3.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 1.4830 -4.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 -0.0370 -5.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 -0.9610 -6.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 0.7270 -6.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2160 -0.1940 -5.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 1.3420 -4.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -0.2230 -3.6070 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1300 -1.2040 -3.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7310 -1.9750 -3.4970 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8780 -2.9430 -3.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 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 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 49 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 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 49 1 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 49 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 49 1 M END