! Freq RIJCOSX r2scan-3c
%output 
xyzfile=True 
end 
%scf 
maxiter 250 
end
%output
Print[P_Hirshfeld] = 1
end
% maxcore
4800
%pal nprocs 16
end
*xyz 1 1
C    0.17460744   1.29081404  -0.61790284 
C   -0.00069667  -0.00011246  -0.00194525 
C    1.13643188  -0.86187499   0.20036243 
C    1.19945276  -1.71588118   1.32676523 
C    2.30067831  -2.52752633   1.52523076 
C    3.34146828  -2.53245591   0.59516425 
C    3.28865272  -1.70907636  -0.53069362 
C    2.20850370  -0.86809092  -0.72297839 
C   -1.31229149  -0.42930527   0.41306723 
C   -1.67455068  -1.79562631   0.35102675 
C   -2.93978644  -2.19923724   0.73470439 
C   -3.85547300  -1.26281824   1.21714151 
C   -3.50979700   0.08691250   1.30142318 
C   -2.25914408   0.50787829   0.88984548 
C    1.36152419   2.03190060  -0.40821436 
C    1.51670997   3.27755605  -0.98690733 
C    0.51470175   3.79583621  -1.80892808 
C   -0.65577022   3.07155916  -2.04073995 
C   -0.83694381   1.83912067  -1.44158917 
H    0.40444729  -1.68423823   2.06503757 
H    2.35818712  -3.15498499   2.40888163 
H    4.19857099  -3.18153189   0.74843704 
H    4.09151632  -1.73353094  -1.26051044 
H    2.14812670  -0.25205741  -1.61460053 
H   -0.97187429  -2.51547499  -0.05653722 
H   -3.22239908  -3.24388321   0.65279861 
H   -4.84379649  -1.58665347   1.52975323 
H   -4.21937598   0.80612688   1.69772624 
H   -1.97508196   1.55096030   0.98683057 
H    2.12333419   1.64160384   0.25917135 
H    2.41509232   3.85531735  -0.79476687 
H    0.64678529   4.76940223  -2.27167399 
H   -1.42142825   3.47128050  -2.69788489 
H   -1.73038181   1.25819173  -1.64749455 
*
