C Fe 1.0000000000000000 1.8325917670653300 -3.1741420500895901 0.0000000000000000 1.8325917670653300 3.1741420500895901 0.0000000000000000 0.0000000000000000 0.0000000000000000 2.9122416850826300 C Fe 1 2 Cartesian 0.0000000000000000 0.0000000000000000 0.0000000000000000 1.8325917670653300 1.0580473500298846 0.0000000000000000 1.8325917670653300 -1.0580473500298850 0.0000000000000000