Mo2FeCoB2 (space group: P-4m2 #115, crystal system: tetragonal, point group: -42m) (missed expected composition: Mo2FeCoB2)
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -50.4883 eV; energy change = -0.0216 eV; symmetry: P-4m2 → P-4m2