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 0.32231326 0.70160139 0.50705383 # 1 O1 0.31373791 0.22384972 0.48338138 # 2 O2 0.43595983 0.71260920 0.58613654 # 3 H1 0.30443694 0.56288479 0.49385812 # 4 H2 0.36084040 0.15323849 0.37332221 # 5 H3 0.23083096 0.13381216 0.54932313 # 6 H4