object 1 class array type float rank 0 items 26 data 0 attribute "dep" string "positions" # object 2 class array type float rank 1 shape 3 items 26 data 339 attribute "dep" string "positions" # object 3 class array type int rank 1 shape 2 items 28 data 1354 attribute "element type" string "lines" attribute "ref" string "positions" # object "molecule" class field component "data" value 1 component "positions" value 2 component "connections" value 3 attribute "name" string "molecule" # end 1 3 3 3 3 3 3 1 1 3 1 3 2 4 4 3 3 3 3 3 3 1 1 1 1 1 -9.208201 -3.5059 0 -7.1239 -3.4079 0 -5.986001 -1.1295 0 -5.768001 -5.5694 0 -3.4601 -1.1461 0 -3.2205 -5.5388 0 -2.1336 -3.2577 0 -7.0737 0.6481001 0 -6.763801 -7.402201 0 -1.5257 0.9892001 0 -2.0946 -7.2924 0 0.6289 -2.4338 0 0.6435 -0.0345 0 -2.342 3.0705 0 2.1567 -4.066101 0 2.889 1.3853 0 2.914 3.9443 0 5.2105 0.3091 0 5.050001 5.3174 0 7.367601 1.6492 0 7.3071 4.1772 0 1.1664 5.0579 0 5.464301 -1.7477 0 4.9519 7.402201 0 9.208201 0.6654001 0 9.070701 5.2914 0 0 1 1 3 1 2 3 8 2 7 2 4 4 6 5 6 3 5 5 10 4 9 6 11 9 12 11 12 11 14 9 13 12 15 15 16 15 17 17 22 16 21 17 19 19 24 19 20 20 25 20 18 16 18 18 23