PUBCHEM-ZINC05557989 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 -1.5450 0.8520 1.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -0.2760 0.5270 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -0.6000 0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 0.1370 0.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -1.9730 -0.5110 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5530 -2.6150 0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 -1.9080 -1.5860 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3150 -0.9720 -2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 -2.9660 -2.5100 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -3.7170 -2.0980 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2110 -4.5450 -1.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -2.7490 -1.2120 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4930 -3.3300 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9300 -1.7830 -1.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 -1.4310 -3.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 -4.2840 -3.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -4.4300 -4.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4670 -3.3240 -3.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 -2.8790 -4.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7440 -2.1030 -1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1840 -3.3480 -0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4520 -3.4920 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3040 -2.3900 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8790 -1.1320 -0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6090 -1.0020 -0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7700 -0.0950 -0.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2920 1.2150 -0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5560 -2.4360 0.7170 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9890 -3.6770 1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 0.9350 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 1.7580 0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 0.7140 1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 -0.8120 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -5.2400 -3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -3.6170 -3.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 -5.3940 -4.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -4.3020 -5.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5410 -4.2210 -0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7390 -4.4810 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2550 -0.0400 -1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4180 1.4600 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0870 1.9210 -0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0770 1.3360 -1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0760 -4.4390 0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9860 -3.5260 1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3300 -4.0100 2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8200 -1.4070 -1.0170 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 33 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 47 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 40 1 0 0 0 0 26 27 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 28 29 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 M CHG 1 47 -1 M END