PUBCHEM-ZINC06159242 MOE2007 3D CORINA 3.40 0006 02.08.2006 72 74 0 0 1 0 0 0 0 0999 V2000 0.9470 2.8290 0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 1.5700 0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 0.7100 1.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 2.0090 0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 0.7950 -0.6220 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 0.2430 -0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6930 0.2980 0.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 -0.4570 -2.0980 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3380 -0.1210 -2.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 -1.9620 -1.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 -2.7680 -3.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 -2.4400 -3.6300 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3440 -2.7080 -2.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9440 -3.2870 -4.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3420 -2.9840 -5.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5180 -1.4990 -5.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1760 -0.6390 -4.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7620 -0.9320 -3.9360 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0070 -0.6410 -4.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7540 1.3630 -2.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 2.1550 -3.6290 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7610 1.9930 -3.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 3.6590 -3.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1260 4.4940 -4.3630 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1120 4.3600 -3.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 5.9600 -4.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 6.8570 -3.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 8.2080 -3.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 8.6920 -4.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9130 7.7960 -5.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5670 6.4440 -5.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5550 10.1520 -4.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6100 10.6080 -2.8950 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 3.9760 -5.7010 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 1.7280 -4.9840 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 2.4680 -5.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9850 2.5830 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 3.4330 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 3.4570 1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 1.2520 2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 -0.2110 1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 0.4170 2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4390 2.6260 -0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0220 1.1420 0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 2.5940 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 0.6700 -1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5720 -2.2840 -1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 -2.1890 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 -3.8370 -2.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 -2.5550 -3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8760 -4.3530 -4.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2060 -3.0940 -5.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0890 -3.3090 -4.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5220 -3.5590 -6.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5510 -1.3030 -5.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8740 -1.2080 -6.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9160 -0.8160 -3.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2750 0.4070 -4.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7970 1.4720 -3.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7020 1.7380 -1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0910 3.9890 -2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1310 3.8210 -3.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 6.5150 -2.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 8.8890 -2.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7540 8.1420 -5.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1520 5.7670 -5.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5350 10.3260 -4.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8030 10.7300 -4.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 11.5480 -2.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 4.6920 -6.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 -0.1460 -2.6520 N 0 3 0 0 0 0 0 0 0 0 0 0 4.1110 -0.4900 -1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 46 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 71 1 0 0 0 0 10 11 1 0 0 0 0 10 47 1 0 0 0 0 10 48 1 0 0 0 0 11 12 1 0 0 0 0 11 49 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 16 55 1 0 0 0 0 16 56 1 0 0 0 0 17 18 1 0 0 0 0 17 57 1 0 0 0 0 17 58 1 0 0 0 0 18 19 1 0 0 0 0 18 71 1 0 0 0 0 20 21 1 0 0 0 0 20 59 1 0 0 0 0 20 60 1 0 0 0 0 20 71 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 35 1 0 0 0 0 23 24 1 0 0 0 0 23 61 1 0 0 0 0 23 62 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 34 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 63 1 0 0 0 0 28 29 1 0 0 0 0 28 64 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 65 1 0 0 0 0 31 66 1 0 0 0 0 32 33 1 0 0 0 0 32 67 1 0 0 0 0 32 68 1 0 0 0 0 33 69 1 0 0 0 0 34 70 1 0 0 0 0 35 36 1 0 0 0 0 71 72 1 0 0 0 0 M CHG 1 71 1 M END