$ show pointgroup # 5 atoms D4h Ci {0.0 0.0 0.0} D4h nC4 1 2 D4h C4_1 (0.0, 0.0, -1.0) D4h nC2 5 1 D4h C2_1 (-0.70710677, 0.70710677, 0.0) D4h C2_2 (0.0, 0.0, -1.0) D4h C2_3 (0.0, -1.0, 0.0) D4h C2_4 (-0.70710677, -0.70710677, 0.0) D4h C2_5 (1.0, 0.0, 0.0) D4h nS4 1 2 D4h S4_1 (0.0, 0.0, -1.0) D4h nCs 5 1 D4h Cs_1 (0.0, 0.0, -1.0) D4h Cs_2 (0.70710677, 0.70710677, 0.0) D4h Cs_3 (0.0, 1.0, 0.0) D4h Cs_4 (-0.70710677, 0.70710677, 0.0) D4h Cs_5 (-1.0, 0.0, 0.0) D4h type nType nUnique D4h E 1 1 D4h Ci 1 1 D4h Cs 5 5 D4h Cn 6 7 D4h Sn 1 2 D4h TOTAL 16 $ draw pointgroup\ $ draw delete $ draw pointgroup c4 $ rotate z 90 $ draw delete $ draw pointgroup c2 $ rotate x,y 180 $ draw delete $ draw pointgroup Cs $ draw delete $ draw pointgroup Cs 1, Cs 2 $ draw delete $ draw pointgroup Cs 1 $ draw delete $ draw pointgroup Cs 2 $ draw delete $ draw pointgroup Cs 3 $ draw delete $ draw pointgroup Cs 4 $ draw delete $ draw pointgroup Cs 5 $ draw delete $ draw pointgroup nCs $ draw delete $ draw pointgroup s4 1 $ draw delete