24
0 of /lustre/lwork/pjhsu/mono_saccharides/no_sodiated/alpha-mannose_PJ_HS/tsca_xyz/BRK.xyz zpe= -687.211627 src= /lustre/lwork/pjhsu/mono_saccharides/no_sodiated/alpha-mannose_PJ_HS/join.xyz moment= 2.423904 0.700629 -0.195511 3.435530 2.621606 1.073304 -0.184441 2.992241 3.930085 1.759242 -0.277699 2.255980 3.797076 1.749177 -0.246281 2.118145 top= BRK
O -1.052640 2.512073 0.140027
O  1.736668 2.223210 -0.254597
O  2.227762 0.006291 1.242261
O  0.254177 -1.761412 -1.236458
O  -1.286521 0.247640 0.408569
O  -0.450751 -1.016898 2.189532
C  -0.392014 1.347297 0.554673
C  0.802554 1.152354 -0.367585
C  1.548264 -0.130725 0.006368
C  0.583258 -1.330421 0.084794
C  -0.757253 -1.020090 0.806073
C  -1.846013 -2.035236 0.486531
H  -1.780580 2.692135 0.744764
H  1.249671 3.050405 -0.346327
H  2.658142 0.871006 1.228222
H  1.056283 -2.078937 -1.662672
H  -1.284164 -0.986722 2.673308
H  -0.070494 1.421635 1.599245
H  0.420612 1.067724 -1.391141
H  2.275350 -0.344400 -0.792301
H  1.074121 -2.128497 0.650273
H  -2.097851 -2.013065 -0.571458
H  -2.739620 -1.789752 1.068099
H  -1.510254 -3.038393 0.754686
