No title 1.0 7.00000000 0.00000000 0.00000000 0.00000000 7.00000000 0.00000000 0.00000000 0.00000000 7.00000000 O H 2 4 Direct 0.32168558 0.72448146 0.50776086 # 1 O1 0.31436560 0.20096965 0.48267435 # 2 O2 0.43533214 0.73548927 0.58684357 # 3 H1 0.30380925 0.58576486 0.49456515 # 4 H2 0.36146809 0.13035842 0.37261518 # 5 H3 0.23145865 0.11093209 0.54861610 # 6 H4