PUBCHEM-ZINC03688141 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 0.6050 0.7860 -1.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -0.5810 -1.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -0.9380 -0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -0.0660 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 -0.5270 0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 -1.8650 0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 -2.7630 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1490 -2.2900 -0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 -3.1520 -1.9060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 -3.7040 -1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5810 -4.1630 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4840 -5.1420 0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 -6.3340 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2900 -7.6310 0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9180 -8.5950 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3210 -8.2820 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1120 -7.0040 -1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4910 -6.0550 -0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 -4.7460 -1.2280 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3170 -4.2700 -2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1460 -9.9070 0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3290 -10.9660 1.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 -4.9970 2.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8790 -4.7460 3.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1920 -4.4340 4.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2150 -4.1270 5.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 0.8950 -2.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 1.4290 -2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 1.0980 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 0.9840 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8500 0.1620 1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5580 -2.1990 1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 -2.9350 -1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -4.2190 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -4.4410 -2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9710 -7.8740 1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8060 -9.0330 -1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4220 -6.7640 -2.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 -5.9030 2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -4.1770 2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -3.9110 3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5260 -5.6250 3.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5700 -5.2860 4.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 -3.5750 4.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8360 -3.2640 5.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8540 -4.9880 5.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 -3.7860 6.9810 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.1700 -3.5500 7.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 -2.9740 6.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9310 -4.5700 7.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 23 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 36 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 21 22 3 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 47 50 1 0 0 0 0 M CHG 1 47 1 M END