%chk=000249548.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249548

0 1
O -0.553048 0.389312 0.190076
O -1.306445 3.884421 0.222112
O -0.671119 -2.720258 0.031566
O 2.615586 -0.397623 0.432502
O 0.346563 2.042573 1.447047
O -2.757952 -2.131365 -0.635318
O 2.464198 1.338629 -1.017096
C 0.254226 -0.627332 0.864870
C -1.162432 2.625201 -0.437450
C -0.718836 -1.777561 1.136172
C 1.396534 -0.991016 -0.088583
C -0.369819 1.706449 0.534877
C -0.337706 2.764591 -1.709909
C -2.584280 2.133085 -0.644125
C -1.759709 -2.777465 -0.828751
C 3.026568 0.820534 -0.081256
C -1.443660 -3.745172 -1.912657
C 4.206857 1.286293 0.691183
H 0.652192 -0.197736 1.820172
H -1.755846 -1.401623 1.274209
H -0.406448 -2.389177 2.002413
H 1.200090 -0.635643 -1.119203
H 1.626798 -2.073335 -0.088127
H -0.459908 1.893339 -2.367099
H -0.645477 3.654483 -2.273897
H 0.744286 2.851815 -1.518574
H -2.612782 1.059398 -0.883469
H -3.191720 2.294324 0.258739
H -3.079057 2.680178 -1.456846
H -0.435702 4.248221 0.503107
H -0.492652 -4.275905 -1.745418
H -1.372061 -3.230346 -2.884842
H -2.240474 -4.501093 -2.006029
H 4.674087 0.479534 1.278817
H 3.907474 2.073754 1.406009
H 4.971073 1.719316 0.027578


%chk=000249548-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249548

0 1
O -0.277193 0.188172 0.093446
O -0.744299 3.807844 -0.268613
O -0.693155 -2.675991 -0.182592
O 2.777246 -0.220430 0.895159
O 0.350438 1.988851 1.438193
O -2.825499 -1.772945 -0.533969
O 2.654964 0.924595 -1.140641
C 0.376510 -0.797728 1.008137
C -1.021269 2.397576 -0.578742
C -0.597237 -1.971568 1.120260
C 1.749408 -1.187184 0.439024
C -0.231429 1.532301 0.421124
C -0.557706 2.149518 -2.028164
C -2.534968 2.108350 -0.393902
C -1.860113 -2.447801 -0.945819
C 3.113295 0.830871 0.018207
C -1.734856 -3.125433 -2.290077
C 4.049350 1.794631 0.703754
H 0.513082 -0.323681 2.000354
H -1.599138 -1.616578 1.417817
H -0.220179 -2.719224 1.838069
H 1.720213 -1.224285 -0.662715
H 2.072087 -2.158094 0.848185
H -0.845242 1.139422 -2.364010
H -1.042039 2.901224 -2.674324
H 0.535859 2.256065 -2.116199
H -2.776634 1.055021 -0.618444
H -2.853391 2.337467 0.639046
H -3.096310 2.766967 -1.078206
H -0.382894 3.854460 0.658281
H -1.262451 -4.115395 -2.188151
H -1.091254 -2.513762 -2.948399
H -2.728119 -3.218387 -2.752699
H 4.761379 1.261754 1.353236
H 3.448390 2.468583 1.341891
H 4.582554 2.397614 -0.045717


