16
Lattice="7.704692813972876 -9.067033523461253e-18 -8.878330680151008e-18 3.981541984312072e-16 6.586526560122781 -9.588856751300861e-09 3.8202265116423234e-16 -1.3224726218403898e-08 6.334800287243859" Properties=species:S:1:pos:R:3:forces:R:3 energy=487.5857737230744 stress="-0.00012605487850955645 0.0 0.0 0.0 -1.4023201241351419e-05 -1.2371303914690049e-08 0.0 -1.2371303914690049e-08 0.00011628800402292302" pbc="T T T"
Ti       3.85234641       1.07453285       3.18793374       0.00000000      -0.00061420      -0.00530885
Ti       0.00000000       5.51199387       0.02053385       0.00000000       0.00060992      -0.00531169
Be       3.85234641       5.45425539       6.31173707       0.00000000      -0.00084248      -0.00358166
Be       0.00000000       1.13227111       3.14433691       0.00000000       0.00084251      -0.00358105
Cu       5.80085361       4.49369366       3.04952062       0.00316296      -0.00143717       0.00267490
Cu       1.90383920       4.49369366       3.04952062      -0.00316296      -0.00143717       0.00267490
Cu       5.75618560       2.09283293       6.21692080      -0.00316283       0.00143719       0.00267451
Cu       1.94850722       2.09283293       6.21692080       0.00316283       0.00143719       0.00267451
Se       3.85234641       0.94523161       0.77963298       0.00000000      -0.00082488       0.00279075
Se       0.00000000       5.64129493       3.94703316       0.00000000       0.00082496       0.00279237
Se       3.85234641       5.44170844       4.07119758       0.00000000      -0.00085257      -0.00512097
Se       0.00000000       1.14481799       0.90379742       0.00000000       0.00085618      -0.00512009
Se       5.66877739       4.36697550       0.68099269      -0.00254413      -0.00087176       0.00256384
Se       2.03591542       4.36697550       0.68099269       0.00254413      -0.00087176       0.00256384
Se       5.88826174       2.21955105       3.84839276       0.00254529       0.00087201       0.00256445
Se       1.81643107       2.21955105       3.84839276      -0.00254529       0.00087201       0.00256445