path: root/sim/src/tests/singlebond_stretch/test_HO_BH2.xyzcmp

5
HO_BH2.mmp
O -0.609000 -0.081000 0.000000
B 0.743000 0.035000 0.000000
H -1.075000 0.765000 0.000000
H 1.264000 1.116000 0.000000
H 1.368000 -0.982000 0.000000