9
pyrazole molec optimized by CAM-B3LYPp2p, SG=m
C       -5.820450000      1.874000000      0.000000000
C       -6.292860000      0.583510000      0.000000000
C       -4.420160000      1.738800000      0.000000000
N       -4.033360000      0.460850000      0.000000000
N       -5.190780000     -0.221440000      0.000000000
H       -7.292370000      0.173490000      0.000000000
H       -6.401950000      2.784580000      0.000000000
H       -3.666940000      2.516280000      0.000000000
H       -5.151890000     -1.235450000      0.000000000









