# Details of computing
0: YAWPUK.cif
1: YAWQUL.cif
2: ZZZWOU01.cif


-------------------------------------

	0	1	2
0	0.0000	6.4127	8.8340
1	6.4127	0.0000	10.2051
2	8.8340	10.2051	0.0000