Lines Matching defs:atom
10 {"atom" :"C", "xyz" : [ 0.00000000000000, 0.00000000000000, 2.64112304663605] }, string
11 {"atom" :"C", "xyz" : [ 2.28770766388446, 0.00000000000000, 1.32067631141874] }, string
12 {"atom" :"C", "xyz" : [ 2.28770047235649, 0.00000000000000, -1.32071294538560] }, string
13 {"atom" :"C", "xyz" : [ 0.00000000000000, 0.00000000000000, -2.64114665444819] }, string
14 {"atom" :"C", "xyz" : [ -2.28770047235649, 0.00000000000000, -1.32071294538560] }, string
15 {"atom" :"C", "xyz" : [ -2.28770766388446, 0.00000000000000, 1.32067631141874] }, string
16 {"atom" :"H", "xyz" : [ 4.07221260176630, 0.00000000000000, 2.35164689765998] }, string
17 {"atom" :"H", "xyz" : [ 4.07221517814719, 0.00000000000000, -2.35163163881380] }, string
18 {"atom" :"H", "xyz" : [ 0.00000000000000, 0.00000000000000, -4.70191324441092] }, string
19 {"atom" :"H", "xyz" : [ -4.07221517814719, 0.00000000000000, -2.35163163881380] }, string
20 {"atom" :"H", "xyz" : [ -4.07221260176630, 0.00000000000000, 2.35164689765998] }, string
21 {"atom" :"H", "xyz" : [ 0.00000000000000, 0.00000000000000, 4.70197960246451] } string