40
piba115_bu_et.xyz
Zr      -0.0468  -0.0561   0.1749
C        2.0996   0.3643   0.6505
C        2.7493   1.4094  -0.2116
C        1.2408  -0.7749  -1.8020
C        0.4908   0.3360  -2.2214
C       -0.8758  -0.0230  -2.1875
C       -0.9718  -1.3409  -1.7278
C        0.3355  -1.8085  -1.4873
H        2.3275  -0.8511  -1.7740
H        0.8989   1.2944  -2.5546
H       -1.7132   0.5874  -2.5279
H       -1.8899  -1.9180  -1.6196
H        0.6112  -2.8205  -1.1853
C       -0.2012  -0.2972   2.6647
C        0.3940  -1.4667   2.1600
C       -0.5664  -2.1301   1.3728
C       -1.7492  -1.3646   1.3806
C       -1.5221  -0.2366   2.1878
H        0.2758   0.4251   3.3327
H        1.4062  -1.8127   2.3718
H       -0.4447  -3.1009   0.8914
H       -2.6901  -1.6323   0.8985
H       -2.2585   0.5349   2.4290
H        3.1507   0.9690  -1.1448
H        2.0169   2.1786  -0.5509
H        1.8733   0.8103   1.6517
H        2.8005  -0.4631   0.8642
C       -0.7377   2.4412   0.6015
H        0.1374   3.0033   0.2448
H       -0.8233   2.2806   1.6847
C       -1.7130   2.0844  -0.2412
H       -1.6807   2.3782  -1.2933
H       -2.6221   1.5827   0.1110
C        3.8679   2.1372   0.5025
H        3.4731   2.5986   1.4286
H        4.6130   1.3879   0.8318
C        4.5193   3.1784  -0.3658
H        4.9423   2.7252  -1.2796
H        3.7960   3.9516  -0.6794
H        5.3414   3.6878   0.1627
