PUBCHEM-ZINC05985229 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.1520 -0.3570 -0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 0.4620 0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -0.1290 1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 0.2170 1.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8820 -0.3630 2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 -1.2930 3.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9950 -1.6430 3.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 -1.0620 2.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1090 -1.9670 4.4070 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8950 -1.2980 4.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7480 -3.2840 3.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6530 -3.3180 2.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2440 -4.5170 2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9540 -5.7080 3.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0690 -5.6880 4.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 -4.4880 4.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 -4.5200 5.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 -3.1780 6.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4560 -6.9430 2.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5260 -6.9900 1.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0840 -8.4140 1.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5940 -9.5270 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3070 -10.7800 2.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 -1.3810 -0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 0.0960 -1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -0.4110 -1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 1.4910 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 0.5320 0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 0.9410 0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9270 -0.0770 2.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -1.3790 2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9140 -2.4110 2.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9200 -4.4790 1.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8450 -6.6200 4.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 -4.7940 5.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8700 -5.2870 6.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 -3.1660 7.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 -2.9050 6.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1560 -6.7200 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3310 -6.3040 2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8700 -8.5600 1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4800 -8.6410 2.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4620 -9.8760 -0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2720 -8.5410 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7640 -10.2330 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4710 -10.6670 3.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2050 -11.1560 1.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4530 -11.4390 2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 -2.1240 5.5770 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0180 -1.2120 6.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -2.3240 5.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9780 -9.4250 1.6160 N 0 3 0 0 0 0 0 0 0 0 0 0 5.1550 -9.0740 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 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 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 49 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 52 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 52 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 52 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 49 1 M CHG 1 52 1 M END