PUBCHEM-ZINC00169417 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 35 0 0 0 0 0 0 0 0999 V2000 0.8760 -0.2180 1.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 0.0050 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -0.6240 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -2.1600 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6140 -2.8180 0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4430 1.1590 -1.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2390 1.3600 -2.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6330 1.1900 -2.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3740 1.3450 -3.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7370 1.6650 -5.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3480 1.8270 -5.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5950 1.6740 -3.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 2.1560 -6.2910 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.3700 2.3780 -7.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 2.1870 -6.2800 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8040 0.3630 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 0.1020 2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -1.2680 1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 1.0880 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -0.3870 -0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 -0.2100 0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 -2.5870 -0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 -2.4420 1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2150 -2.3620 1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1670 -2.7500 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -3.8820 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 1.8160 -1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0510 1.3820 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1620 0.9430 -1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4550 1.2170 -3.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3340 1.7800 -5.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 1.8060 -3.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9680 -0.2550 -1.2680 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3510 -0.4760 -2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7960 -0.8480 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M CHG 1 33 1 M END