PUBCHEM-ZINC05763689 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0130 -0.4020 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -0.5460 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 -1.5930 0.6150 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 -1.6540 -0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 -2.6750 -1.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -0.4970 -1.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5240 -2.3130 1.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2300 -3.2310 0.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1670 -4.0010 1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0200 -5.0460 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7810 -5.5330 1.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4300 -4.8400 2.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4820 -3.9390 2.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0250 -5.0660 4.1430 N 0 3 0 0 0 0 0 0 0 0 0 0 6.9600 -5.9790 4.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6180 -4.3530 5.1740 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 0.2410 1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -0.9760 1.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -2.6410 -2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0680 -3.3680 -0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0390 -5.3630 -0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5220 -6.3140 1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 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 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 7 24 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END