24
0 of /lustre/lwork/pjhsu/mono_saccharides/no_sodiated/beta-galactose_PJ_HS/tsca_xyz/4C1.xyz zpe= -687.203702 src= /lustre/lwork/pjhsu/mono_saccharides/no_sodiated/beta-galactose_PJ_HS/join.xyz moment= 2.411826 0.711551 -0.104173 3.114041 2.607108 1.057013 -0.268450 3.191129 3.915508 1.779735 -0.159147 2.315295 3.813296 1.721832 -0.300642 2.218151 top= 4C1
O 1.552257 -2.216346 0.337843
O  -1.238152 -2.452625 -0.042817
O  -2.776497 -0.021225 0.349774
O  -0.899439 1.519430 1.532328
O  1.395870 0.017441 0.212301
O  1.725432 2.435468 1.563242
C  0.765893 -1.186208 -0.183387
C  -0.662889 -1.213101 0.357173
C  -1.455638 -0.018622 -0.179007
C  -0.717895 1.288848 0.137501
C  0.755152 1.182954 -0.304617
C  1.621930 2.358846 0.138404
H  1.002120 -3.009702 0.360279
H  -2.176535 -2.425475 0.180505
H  -2.724768 0.387520 1.225517
H  -0.131826 2.003425 1.876781
H  2.176688 1.634846 1.860357
H  0.748808 -1.236408 -1.286892
H  -0.605130 -1.148699 1.450679
H  -1.564680 -0.126981 -1.263105
H  -1.180254 2.108144 -0.432017
H  0.761121 1.152767 -1.406835
H  2.615113 2.265530 -0.312161
H  1.178011 3.300440 -0.190463
