PUBCHEM-ZINC04759593 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 32 0 0 1 0 0 0 0 0999 V2000 -0.0360 1.3770 0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.1230 0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.8280 1.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.6810 -0.9420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -2.1320 -1.0880 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4250 -2.6320 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 -2.5130 -1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -3.9720 -1.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5540 -4.5040 -1.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 -4.6530 -0.3060 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.4440 -2.5650 -2.4420 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4210 -3.6530 -2.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 -2.0750 -2.5720 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9100 -0.9880 -2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 -2.5080 -3.9260 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4300 -3.5960 -3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8960 -2.0180 -4.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4630 -2.5210 -5.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 -1.9450 -4.9750 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 -2.6390 -1.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 -2.0020 -3.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 1.7620 0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 1.8120 -0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 1.6400 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -0.1220 -1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 -2.0940 -1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -2.1170 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4790 -2.3760 -3.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9100 -0.9280 -4.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3790 -2.2490 -5.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 -0.9780 -4.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7030 -3.6050 -1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -1.0350 -3.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 19 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M END