Chemeleon generated FeN crystal (space group: P1 #1, crystal system: triclinic, point group: 1) (missed requested crystal system: orthorhombic)
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -15.0397 eV; energy change = 0.0007 eV; symmetry: P4/mmm → P4/mmm