PUBCHEM-ZINC04774781 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.8450 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -2.5710 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8750 -2.4280 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9950 -1.5980 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2620 -2.1480 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4310 -3.5230 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3350 -4.3630 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0460 -3.8270 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 -4.7180 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -4.8990 -1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 -4.2260 -2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 -4.4090 -3.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 -5.3020 -3.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 -5.4790 -4.5810 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7780 -4.7800 -5.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 -6.3740 -4.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -5.9760 -2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -5.7940 -1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -6.4370 -0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -6.2910 1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -5.4430 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1560 -5.3000 2.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 -5.9780 3.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 -6.8150 3.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -6.9770 2.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -7.5000 4.5890 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5160 -5.8220 4.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8720 -0.5250 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1270 -1.5020 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4260 -3.9410 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4750 -5.4340 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 -3.5660 -2.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 -3.8950 -4.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -3.8190 -5.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 -5.3830 -6.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -4.6180 -5.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9870 -7.3840 -4.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0430 -6.0250 -5.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 -6.3780 -3.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -6.6350 -2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0190 -4.6530 2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 -7.6260 2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 -7.3950 5.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 -8.0820 4.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 -6.5740 4.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8370 -5.9530 5.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 -4.8270 4.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 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 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 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 17 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 M CHG 1 17 1 M END