water __Jmol-14_03061823253D 1 1.00000 0.00000 0 Jmol version 14.20.4 2017-07-27 08:15 EXTRACT: ({1 5 6}) 3 2 0 0 0 0 999 V2000 -0.0123 0.3596 0.5807 O 0 0 0 0 0 0 -0.7809 0.9522 0.6236 H 0 0 0 0 0 0 0.7444 0.9562 0.6492 H 0 0 0 0 0 0 1 2 1 0 0 0 3 1 1 0 0 0 M END