PUBCHEM-ZINC04557163 MOE2007 3D CORINA 3.40 0006 02.08.2006 75 78 0 0 1 0 0 0 0 0999 V2000 0.4310 -1.3400 0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -2.7760 0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -3.7010 0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -5.0390 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 -5.8580 -0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -5.4320 -0.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5440 -4.5630 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 -3.2130 0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 -2.3100 0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 -2.7440 0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8920 -4.0800 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8540 -4.9860 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1760 -4.4970 -0.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2000 -3.5120 0.0890 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.0380 -2.9660 1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5670 -4.2000 0.1330 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.6140 -4.8620 0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6620 -3.1360 0.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.5470 -2.5880 1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5360 -2.1670 -0.9380 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.2780 -1.3740 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1320 -1.5570 -0.9410 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.9830 -0.9850 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1600 -2.6030 -1.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9790 -0.6340 -2.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7120 0.0250 -2.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7540 -2.8730 -2.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0900 -2.7770 -2.6590 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.7900 -3.0880 -1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2470 -3.6850 -3.8810 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.0820 -4.7220 -3.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6630 -3.5310 -4.4440 C 0 0 3 0 0 0 0 0 0 0 0 0 -12.3890 -3.8620 -3.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9090 -2.0570 -4.7800 C 0 0 3 0 0 0 0 0 0 0 0 0 -12.9340 -1.9290 -5.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6890 -1.2120 -3.5220 C 0 0 3 0 0 0 0 0 0 0 0 0 -12.4090 -1.5020 -2.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3630 -1.4250 -3.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.8740 0.2680 -3.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7840 1.0480 -2.6690 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0010 -1.6420 -5.8010 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.7960 -4.3210 -5.6270 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2680 -3.3040 -4.9030 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7960 -4.2290 -5.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2450 -5.3560 -5.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7090 -3.8640 -6.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9450 -3.7640 0.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7610 -4.9810 -1.0910 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.5090 -6.1020 -1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0930 -6.4170 -0.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6180 -6.9650 -2.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 -1.2240 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -0.6960 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -1.0620 1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1230 -3.4130 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 -1.2740 0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4480 -2.0480 0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0660 -6.0200 -0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0380 -1.2220 -3.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7760 0.1100 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5460 0.6280 -2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0980 0.5810 -4.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8530 0.4160 -4.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8920 1.9980 -2.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1010 -0.7160 -6.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6700 -4.2710 -6.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9610 -2.3860 -4.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3730 -2.8450 -6.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8710 -4.5510 -6.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0970 -3.9310 -7.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0900 -4.3970 0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3520 -4.6920 -1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8830 -7.7680 -2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6190 -7.3930 -2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4330 -6.3590 -3.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 52 1 0 0 0 0 1 53 1 0 0 0 0 1 54 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 55 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 56 1 0 0 0 0 10 11 2 0 0 0 0 10 57 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 58 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 24 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 48 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 47 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 61 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 38 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 43 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 42 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 41 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 39 40 1 0 0 0 0 39 62 1 0 0 0 0 39 63 1 0 0 0 0 40 64 1 0 0 0 0 41 65 1 0 0 0 0 42 66 1 0 0 0 0 43 44 1 0 0 0 0 43 67 1 0 0 0 0 44 45 2 0 0 0 0 44 46 1 0 0 0 0 46 68 1 0 0 0 0 46 69 1 0 0 0 0 46 70 1 0 0 0 0 47 71 1 0 0 0 0 48 49 1 0 0 0 0 48 72 1 0 0 0 0 49 50 2 0 0 0 0 49 51 1 0 0 0 0 51 73 1 0 0 0 0 51 74 1 0 0 0 0 51 75 1 0 0 0 0 M END