PUBCHEM-ZINC03869236 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 21 0 0 1 0 0 0 0 0999 V2000 0.8600 1.2070 0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 -0.2030 0.4330 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1140 -0.9260 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6070 -0.5540 -0.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -2.0450 -0.9030 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0220 -2.6520 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 -2.6010 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7690 -3.3160 -0.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 1.4490 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 1.3050 -0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 1.9550 0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 0.0290 -0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -0.2370 -1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6030 -2.2070 1.3930 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.6480 -2.3050 -2.2130 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0920 -2.7940 -2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 -1.5020 -2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4050 -2.9730 -1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 -0.2780 1.7070 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1990 0.4290 1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -0.2640 2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 -1.2230 1.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 19 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 15 1 0 0 0 0 7 8 2 0 0 0 0 7 14 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 M CHG 1 14 -1 M CHG 1 15 1 M CHG 1 19 1 M END