PUBCHEM-ZINC04773662 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.0660 1.3560 -1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -0.0320 -1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 -0.6820 -0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 0.1040 -0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 1.5010 -0.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 2.1320 -0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6740 1.9790 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4640 0.8700 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 -0.2610 -0.1180 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 -1.6580 0.0710 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8980 -2.1290 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6680 -1.9080 0.3630 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2460 -1.1750 -0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9710 -1.6330 1.8640 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9070 -0.5630 2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9960 -2.3860 2.7860 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2240 -2.1790 3.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 -1.9520 2.4200 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4570 -0.8700 2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2680 -2.2600 1.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 -2.6690 3.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -2.1360 2.9450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 -2.2050 1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1290 -3.8050 2.5970 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3710 -3.8880 1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3200 -2.0290 2.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4090 -2.7960 1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9560 -3.1970 0.1490 O 0 5 0 0 0 0 0 0 0 0 0 0 4.1160 3.3950 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9710 3.8690 1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 1.8430 -1.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 -0.6240 -1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 -1.7670 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 3.2150 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5050 0.8180 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 -3.7440 3.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 -2.5140 4.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1640 3.4790 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 4.0470 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9210 3.9780 1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4690 3.2000 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6080 5.2030 1.6050 N 0 3 0 0 0 0 0 0 0 0 0 0 4.4930 5.5440 2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2000 5.9040 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6190 5.1560 1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 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 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 20 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 28 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 24 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 29 30 1 0 0 0 0 29 38 1 0 0 0 0 29 39 1 0 0 0 0 30 40 1 0 0 0 0 30 41 1 0 0 0 0 30 42 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42 45 1 0 0 0 0 M CHG 1 28 -1 M CHG 1 42 1 M END