# read a general triclinic data file read_data data.general mass * 1.0 write_data tmp.data.general triclinic/general pair_style lj/cut 1.2 pair_coeff * * 1.0 1.0 neighbor 0.0 bin thermo_style custom step pe avecx avecy avecz bvecx bvecy bvecz & cvecx cvecy cvecz pxx pyy pzz vol thermo_modify triclinic/general yes dump 1 all custom 100 tmp.dump.general id type x y z dump_modify 1 triclinic/general yes run 0