PUBCHEM-ZINC00967377 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -0.6000 -1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 0.0700 -1.9210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -2.1040 -1.1200 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8610 -2.5100 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 -2.6330 -1.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5850 -3.1430 -0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7960 -3.6290 -1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0830 -3.6050 -2.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1600 -3.0950 -3.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 -2.6050 -2.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7270 -2.5050 -2.0430 N 0 5 0 0 0 0 0 0 0 0 0 0 1.5620 -2.1400 -2.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -3.1610 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 -4.0270 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0280 -3.9850 -2.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -3.0760 -4.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -2.2030 -3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 13 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 18 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 10 11 2 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 M CHG 1 13 -1 M END