H  O 
 1.0000000000000000
     5.0896295799178368    0.0000000000000000   -0.0000000000000000
     0.0000000000000000    5.0896295799178377   -0.0000000000000000
    -0.0000000000000000   -0.0000000000000000    9.1763928939995161
 H   O  
   8   8
Selective dynamics
Cartesian
  4.3042055400463157  1.7774841219498110  1.2870432735096671   T   T   T
  0.7854240398715152  3.3121454579680285  5.8752397205094233   T   T   T
  0.7673306680091107  1.7593907500874015  3.5811414970095461   T   T   T
  4.3222989119087210  3.3302388298304364  8.1693379440092908   T   T   T
  3.3302388298304315  4.3222989119087289  1.0070549499902108   T   T   T
  1.7593907500873986  0.7673306680091122  5.5952513969899620   T   T   T
  1.7774841219498068  4.3042055400463246  7.8893496204898428   T   T   T
  3.3121454579680245  0.7854240398715178  3.3011531734900874   T   T   T
 -0.3301460681257554  1.2624051965816976  2.0130137938703472   T   T   T
  5.4197756480435819  3.8272243833361421  6.6012102408701070   T   T   T
  1.2824095933772186  2.2146687218331627  4.3071120173702298   T   T   T
  3.8072199865406109  2.8749608580846755  8.8953084643699718   T   T   T
  2.8749608580846706  3.8072199865406193  0.2810844296295291   T   T   T
  2.2146687218331569  1.2824095933772237  4.8692808766292881   T   T   T
  1.2624051965816938 -0.3301460681257546  7.1633791001291618   T   T   T
  3.8272243833361355  5.4197756480435926  2.5751826531294051   T   T   T