PUBCHEM-ZINC04824677 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 37 0 0 1 0 0 0 0 0999 V2000 2.0870 1.2940 -1.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 -0.0670 -1.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 -0.4360 -0.5330 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3370 0.6780 0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 1.7790 -0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 3.0340 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 3.0940 1.4470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 1.9470 2.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 0.7000 1.5560 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 4.2070 -0.4650 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 -1.7980 -0.1810 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1330 -2.3970 -1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 -2.4580 0.9630 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1200 -1.7630 1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -3.4420 1.4370 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7000 -4.2520 0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -2.5420 1.4290 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3640 -1.8020 2.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 -1.8480 0.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 -3.3790 1.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -4.0220 2.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 -5.0340 3.1450 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 -6.1140 2.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 -4.0070 2.7160 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 -3.1250 0.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2600 -3.7430 1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 1.8750 -2.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -0.8020 -2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 2.0430 3.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 4.2280 -1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 5.0530 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5700 -2.7450 1.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8420 -4.1260 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -5.3650 4.6090 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 10 30 1 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 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 25 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 24 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 22 34 1 0 0 0 0 25 26 1 0 0 0 0 M CHG 1 34 -1 M END