15 atoms Coords 1 179.976514 14.706016 647.074752 2 180.906514 16.316824 647.074752 3 180.906514 13.095209 647.074752 4 178.116514 14.706016 647.074752 5 179.901295 17.613101 646.197940 6 182.156010 16.145834 646.400644 7 181.144847 16.729629 648.422969 8 182.156010 13.266199 646.400644 9 180.133684 12.098609 646.400644 10 181.144847 12.682404 648.422969 11 177.639847 15.873607 647.748861 12 177.639847 13.538426 647.748861 13 177.639847 14.706016 645.726536 14 180.344431 18.553806 645.945739 15 178.879889 17.418105 645.945739 Types 1 2 2 4 3 4 4 4 5 2 6 1 7 1 8 1 9 1 10 1 11 1 12 1 13 1 14 1 15 1 Charges 1 0.00000000 2 0.00000000 3 0.00000000 4 0.00000000 5 0.00000000 6 0.00000000 7 0.00000000 8 0.00000000 9 0.00000000 10 0.00000000 11 0.00000000 12 0.00000000 13 0.00000000 14 0.00000000 15 0.00000000