4
Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2.1454162889312536 stress="5.346209290308103 -0.07793252348173785 0.3524440144046004 -0.07793252348173785 5.215644623229464 -0.06251230824893561 0.3524440144046004 -0.06251230824893561 5.32131125169647" pbc="F F F"
H      -0.14801295      -0.02432459       0.06329927       2.16900805       1.60464026       2.10403513 
H       1.43745442       1.27846858      -0.00548572      -1.50210844      -1.95572843       1.64767307 
H       1.34126820      -0.15859300       1.31668137      -2.05388320       2.21952717      -1.90665084 
H      -0.08013605       1.24396547       1.59073906       1.38698358      -1.86843900      -1.84505736