32 Lattice="7.671782785961837 0.0 0.0 0.0 7.671782785961837 0.0 0.0 0.0 7.671782785961837" Properties=species:S:1:pos:R:3:forces:R:3 energy=-142.36583170892325 stress="-0.02207550351703462 0.0040537315450997185 0.0022824004437600465 0.0040537315450997185 0.009166667370616133 0.016433192389137867 0.0022824004437600465 0.016433192389137867 0.00325364318667284" pbc="F F F" Ni 0.00368241 0.00141018 0.01838953 0.59238873 0.53689226 0.39479930 Zr 1.89435537 1.95082789 0.01230935 -0.47174024 2.16519359 -0.40532262 Zr 1.88742100 0.03723322 1.88894668 -0.64472076 -0.68263050 2.29959338 Ni 0.04228967 1.90456112 1.92503091 0.12207053 0.33416514 0.17517229 Zr 3.85069588 0.02830397 0.00761626 0.62619098 -0.50710048 -1.30407362 Ni 5.77918176 1.90099045 0.02713364 -0.98211276 0.86611168 0.57706802 Zr 5.76820063 0.01361190 1.91604359 0.23031159 0.80292143 1.29869541 Ni 3.81755325 1.92177148 1.91802490 0.61697909 0.55996103 0.36493491 Ni 0.00765940 3.78965190 0.02515455 0.52282739 0.10674910 0.92131328 Ni 1.97139831 5.72309305 0.02125819 0.22419576 -1.06758276 0.59015163 Ni 1.91113430 3.85215261 1.94371334 -0.17319976 -0.83370633 -0.85331461 Zr 0.02206769 5.72741310 1.92655968 -0.31637223 0.32612700 -1.40101636 Ni 3.82234076 3.83087066 0.02426929 0.31722155 -0.57669604 0.86580485 Zr 5.75643617 5.73349496 0.04227885 0.07560533 -0.74075084 -0.14751603 Ni 5.79023523 3.81624925 1.91900170 -0.29368425 -0.86858810 -0.31567009 Zr 3.86676766 5.71840129 1.94286728 -1.03818797 0.77744612 -1.84350376 Ni 0.01068567 0.03081469 3.86285694 0.12270379 0.72219085 -0.24604869 Ni 1.87661373 1.92199700 3.83674235 0.00623696 -0.39509754 -1.04429993 Zr 1.91125337 0.00706065 5.74725163 0.30873147 -1.32038039 -0.33177346 Zr 0.01412578 1.95110369 5.76231531 -1.33491389 -0.39874705 0.41595185 Ni 3.86171016 0.00548465 3.84358470 0.06935532 0.79136209 -0.59607935 Ni 5.77519104 1.91255810 3.86584481 -0.20576187 0.26936257 -0.28941896 Zr 5.75044861 0.00493332 5.75188223 0.14968100 -0.02884835 -0.63845781 Zr 3.82848431 1.94319309 5.71591402 0.87001495 -0.04402610 0.54171349 Zr 0.00866275 3.82572411 3.80199778 -1.79211367 -1.37068611 -1.06574123 Zr 1.93154644 5.71688120 3.86487142 -0.21520395 2.93703166 0.78727701 Zr 1.95730719 3.86711403 5.79171948 -0.04133765 0.88806649 2.74990415 Ni 0.00604858 5.72610683 5.74706344 -0.08459187 -0.41226330 -0.39690649 Zr 3.81054451 3.86849312 3.86262676 1.39450120 -2.56577618 -1.35130103 Zr 5.72414000 5.78214814 3.86140820 1.48509799 0.38519366 0.65896564 Ni 5.77531283 3.81489486 5.73644565 -0.52465803 -0.31736408 -0.30768504 Ni 3.85845421 5.73108427 5.76585516 0.38448524 -0.33853051 -0.10321613