16
Lattice="6.446741931680057 1.155307312100539 0.0 1.8107897284497247 7.148594429883287 0.0 6.412959424070468e-18 1.6491727391699235e-21 21.41203791" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:forces:R:3:magmoms:R:1 energy=-74.3649758596295 stress="7.5671003955223e-05 -3.0396169819515633e-05 -6.908342925529758e-07 -3.0396169819515633e-05 -1.1246707188013912e-05 -1.15285823706682e-06 -6.908342925529758e-07 -1.15285823706682e-06 0.0001545389162488526" dipole="-23.440330919949112 21.598528697219265 1.951844433045706e-05" magmom=16.000000019397028 free_energy=-74.36579031388214 pbc="T T F"
Mn       2.03011901       2.61423525      12.25967892       1.00000000       0.00719228      -0.00618997      -0.00070001       3.67501299
Mn       5.25349353       3.19188811       9.15239454       1.00000000       0.00734305      -0.00605833       0.00059229       3.67495784
Mn       6.15888482       6.76618605      12.25967892       1.00000000       0.00719377      -0.00619011      -0.00070153       3.67501298
Mn       2.93551735       6.18853159       9.15239432       1.00000000       0.00734477      -0.00605702       0.00059429       3.67495786
Cl       4.05384303       1.98310101      13.10752891       1.00000000       0.00232713      -0.00187753      -0.00244467       0.02875037
Cl       4.18271726       2.29548065       7.50730000       1.00000000      -0.00614522       0.00672479       0.00344655       0.03723329
Cl       0.95929718       1.71775262      13.90473727       1.00000000      -0.00590522       0.00692117      -0.00370381       0.03722708
Cl       0.83046020       1.40549552       8.30451757       1.00000000       0.00244635      -0.00191681       0.00244278       0.02874795
Cl       1.73586705       4.97974459      13.10752912       1.00000000       0.00232582      -0.00187805      -0.00244562       0.02875036
Cl       1.86474114       5.29212414       7.50730000       1.00000000      -0.00614626       0.00672445       0.00344478       0.03723332
Cl       5.08806304       5.86970363      13.90473727       1.00000000      -0.00590624       0.00692101      -0.00370269       0.03722709
Cl       4.95922608       5.55744633       8.30451735       1.00000000       0.00244599      -0.00191703       0.00244326       0.02874794
Cl       6.38308427       4.17276556      11.05526560       1.00000000      -0.00351744       0.00126934      -0.00206692       0.01024451
Cl       3.15972827       3.59511002      10.35672906       1.00000000      -0.00375122       0.00117470       0.00244092       0.01024164
Cl       4.06510823       7.16940914      11.05526560       1.00000000      -0.00351770       0.00126781      -0.00206770       0.01024450
Cl       7.28849403       7.74706108      10.35672906       1.00000000      -0.00375034       0.00117301       0.00244097       0.01024163