12
Lattice="30.0 0.0 0.0 0.0 30.0 0.0 0.0 0.0 30.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-37.6752862879 stress="-10.8525966285 -2.3881327186 -4.0481420465 -2.3881327186 -9.937132576 -4.9196597303 -4.0481420465 -4.9196597303 -1.5125286526" pbc="T T T"
C       14.17107967      14.51533747      13.99074122       0.00000000       0.00000000       0.00000000
C       13.99354474      14.09485573      15.30158390      -0.00037508       0.00002092       0.00093326
C       14.81564459      14.58190784      16.30844847       0.00015635       0.00007843      -0.00054186
C       15.82319967      15.48162596      16.00831681      -0.00021258       0.00172973       0.00063258
C       16.01067403      15.90485126      14.69783871      -0.00040341      -0.00061250      -0.00023888
C       15.18687278      15.41908335      13.69198177       0.00049742       0.00067485      -0.00010184
H       13.52291561      14.15068363      13.20733551      -0.00013270      -0.00013850      -0.00073940
H       13.20598011      13.39448069      15.54361354      -0.00027357       0.00027235      -0.00025905
H       14.66999611      14.25183806      17.32808970      -0.00029606       0.00026275       0.00006271
H       16.46574344      15.86044830      16.79342827      -0.00026113      -0.00078259      -0.00047295
H       16.79362436      16.61378250      14.46668221      -0.00017010       0.00002090      -0.00037343
H       15.32964013      15.75663028      12.67382829       0.00019434      -0.00059894      -0.00061941
