PUBCHEM-ZINC06072860 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -2.5000 -2.4700 N 0 3 0 0 0 0 0 0 0 0 0 0 2.7580 -2.7440 -2.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0020 -3.1740 -3.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7990 -3.1750 -4.5140 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 -3.4280 -5.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -2.7600 -3.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -2.6320 -3.8850 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -2.9570 -5.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -2.7320 -5.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0640 -3.0650 -6.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4830 -4.3520 -6.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9720 -4.6580 -8.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0420 -3.6780 -9.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 -2.3910 -8.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1390 -2.0840 -7.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2890 -3.4910 -4.2430 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3030 -3.3880 -3.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4270 -3.6760 -3.7310 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 -2.9770 -2.1000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8770 -2.9170 -1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8870 -2.6460 -1.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 -2.2740 -0.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5580 -3.9450 -5.6100 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.3880 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 -2.3280 -3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -2.3150 -5.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 -4.0000 -5.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0080 -3.3730 -4.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7480 -1.6880 -5.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4290 -5.1170 -6.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2990 -5.6630 -8.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4230 -3.9170 -10.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6780 -1.6250 -9.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8150 -1.0780 -7.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7790 -3.0860 -6.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4120 -4.6230 -5.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 -4.4660 -5.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 27 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 M CHG 1 5 1 M END