PUBCHEM-ZINC06358182 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 0.0180 -1.4990 1.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -0.9190 0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 -1.3020 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 -1.3860 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -0.8300 -1.2140 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0550 -0.9610 -1.2440 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4200 -0.9100 -2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4900 0.2660 -0.4640 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1830 0.1880 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6780 1.3690 -1.0800 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4540 2.1210 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3270 2.1050 -2.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0780 3.2690 -1.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7140 4.0000 -2.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5830 3.5530 -4.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8570 2.3970 -4.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2440 1.6750 -3.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8280 2.0800 -5.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0160 0.9680 -6.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1780 4.2440 -5.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4530 5.1390 -2.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7690 5.4860 -1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9700 0.0630 -0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8410 0.9070 -0.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1160 -1.3090 -0.3340 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9410 -1.9910 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7310 -3.1740 -0.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 -1.5100 -2.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9230 -2.7650 -2.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -1.1410 1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 -1.1980 2.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -2.5940 1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 0.1730 0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 -2.3770 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 -0.7610 -1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 -1.0480 -0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 -2.4840 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 -1.1190 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1520 3.5880 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6960 0.7700 -3.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4050 0.0370 -5.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 0.8750 -7.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9700 1.1300 -6.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9540 3.7200 -6.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2950 4.6720 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8700 5.7840 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4410 6.3490 -1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9810 -1.7680 -0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 0.6830 -1.3520 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 0.8160 -2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 -0.6960 -3.5010 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 49 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 26 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 49 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 51 -1 M END