PES

Click on ellipse to view 3D structure in popup window (run JSmol)
image/svg+xml kcal/mol 6.0 - 5.5 - 5.0 - 4.5 - 4.0 - ~ ~ 3.5 - 0.5 - 0.0 - 0.00 kcal 4_E_0.00 kcal 3.92 kcal e33.92 kcal 3.92 kcal e53.92 kcal 0.00 kcal _E_10.00 kcal 0.00 kcal 2_E_0.00 kcal 3.92 kcal e13.92 kcal 5.50 kcal 5t15.50 kcal 5.35 kcal 4E5.35 kcal 5.35 kcal 5E5.35 kcal 5.50 kcal 4t35.50 kcal 0.00 kcal _E_40.00 kcal 0.00 kcal 1_E_0.00 kcal 3.92 kcal e23.92 kcal 5.50 kcal 3t25.50 kcal 5.50 kcal 5t45.50 kcal 5.35 kcal 3E5.35 kcal 0.00 kcal 5_E_0.00 kcal 3.92 kcal e43.92 kcal 0.00 kcal _E_50.00 kcal 0.00 kcal 3_E_0.00 kcal 5.50 kcal 4t55.50 kcal 0.00 kcal _E_30.00 kcal 0.00 kcal _E_20.00 kcal 3.92 kcal 2e3.92 kcal 3.92 kcal 5e3.92 kcal 3.92 kcal 1e3.92 kcal 3.92 kcal 3e3.92 kcal 3.92 kcal 4e3.92 kcal 5.35 kcal E45.35 kcal 5.50 kcal 1t25.50 kcal 5.50 kcal 2t35.50 kcal 5.35 kcal E15.35 kcal 5.35 kcal 1E5.35 kcal 5.50 kcal 2t15.50 kcal 5.50 kcal 3t45.50 kcal 5.35 kcal E35.35 kcal 5.35 kcal E25.35 kcal 5.35 kcal 2E5.35 kcal 5.50 kcal 1t55.50 kcal 5.35 kcal E55.35 kcal 5.93 kcal 5T15.93 kcal 5.93 kcal 4T55.93 kcal 5.93 kcal 2T35.93 kcal 5.93 kcal 1T25.93 kcal 5.93 kcal 3T45.93 kcal 5.93 kcal 4T35.93 kcal 5.93 kcal 2T15.93 kcal 5.93 kcal 3T25.93 kcal 5.93 kcal 5T45.93 kcal 5.93 kcal 1T55.93 kcal