[Wien] What is the matter in the step of x sgroup?

[panzhijun2002]

Hi,users of wien2k:
   When I perform the initialization for La0.4FeCo3Sb12,the first step is ok.Unfortunately,the initializaton did not pass the step of x sgroup. The error information is as follows:

   Error: duplicated atoms found! Atoms #2 and #6 coincide.
   Error: duplicated atoms found! Atoms #2 and #6 coincide.
   diff: La0.4FeCo3Sb12.outputsgroup: No such file or directory
   diff: La0.4FeCo3Sb12.outputsgroup1: No such file or directory
   Error: duplicated atoms found! Atoms #2 and #6 coincide.
   0.000u 0.001s 0:00.00 0.0%	   0+0k 0+0io 125pf+0w

What is the matter and how to solve it? Thank you in advance.

                                                            Yours sincerely:
                                                                  Pan Zhijun