PUBCHEM-ZINC01206717 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 67 0 0 1 0 0 0 0 0999 V2000 0.8050 0.4840 -0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 -0.9930 -0.5520 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7550 -1.2000 -1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 -1.8480 0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 -2.3970 -0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3840 -3.1810 0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0310 -3.4150 1.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 -2.8650 2.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 -2.0770 1.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 -1.2980 -0.2770 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 -1.2200 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 -0.9800 -2.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2110 -1.4260 -0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 -1.7090 0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9610 -1.9010 0.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9010 -1.8150 -0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5100 -1.5360 -1.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1660 -1.3330 -1.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7700 -1.0460 -3.2920 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8640 0.3240 -3.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6270 1.0910 -3.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5440 1.1410 -4.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 1.8440 -3.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 2.4980 -2.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 2.4500 -1.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 1.7500 -2.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1920 -2.2540 -4.2680 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 -1.6220 -5.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7060 -3.2700 -3.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5720 -2.9420 -5.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9600 -2.4220 -6.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0420 -2.9600 -7.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7390 -4.0240 -6.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3480 -4.5440 -5.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2620 -4.0060 -4.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8040 -4.5550 -7.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4750 -5.6490 -6.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 0.6900 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 1.1020 -0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 0.7130 0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8520 -2.2140 -1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2900 -3.6120 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6610 -4.0290 2.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 -3.0480 3.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -1.6440 2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 -1.5570 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 -1.7780 1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2780 -2.1200 1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9470 -1.9670 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2480 -1.4710 -2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9490 0.3040 -4.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7420 0.8100 -3.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 0.6290 -5.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 1.8820 -4.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 3.0470 -2.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 2.9610 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4260 1.7150 -1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4160 -1.5940 -6.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3440 -2.5540 -7.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8900 -5.3720 -4.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9550 -4.4140 -3.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3030 -5.9770 -7.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7750 -6.4730 -6.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8580 -5.3300 -5.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 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 41 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 2 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 46 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 16 17 2 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 54 1 0 0 0 0 24 25 2 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 26 57 1 0 0 0 0 27 28 2 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 58 1 0 0 0 0 32 33 1 0 0 0 0 32 59 1 0 0 0 0 33 34 2 0 0 0 0 33 36 1 0 0 0 0 34 35 1 0 0 0 0 34 60 1 0 0 0 0 35 61 1 0 0 0 0 36 37 1 0 0 0 0 37 62 1 0 0 0 0 37 63 1 0 0 0 0 37 64 1 0 0 0 0 M END