# cylindrical groups 1 1 1 90 90 90 1 1 0.50000 0.50000 # C2v C3 1 3.13915 0.57277 -0.84118 C2 1 1.52202 0.27770 -0.40785 C1 1 0.00000 0.00000 0.00000 C2 1 -1.52202 -0.27770 0.40785 C3 1 -3.13915 -0.57277 0.84118 C4 1 -6.3 -1.14 1.68 # D2h C3 2 -0.01000 0.00100 3.29999 C2 2 0.00000 -0.00100 1.60000 C1 2 0.00000 -0.00100 0.00000 C2 2 0.00000 0.00100 -1.60000 C3 2 0.01000 -0.00100 -3.29999