%chk=000258479.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258479

0 1
O 0.645368 -0.947113 -1.471186
O 1.108324 -2.559032 0.056499
O 3.277757 2.948258 -2.071891
O 5.062246 -1.563636 3.000952
O 4.982177 3.372750 -0.800956
O 6.230099 0.237585 2.697285
O -7.048405 2.093970 0.747749
O -5.361562 2.523554 -0.536580
N 4.041429 2.691864 -1.160545
N 5.313817 -0.517334 2.434724
N -6.041302 1.769741 0.140736
C 2.502619 -0.586354 -0.089072
C 3.346529 -0.962451 0.966791
C 2.722192 0.608251 -0.788336
C 3.801983 1.426012 -0.418817
C 4.416689 -0.124471 1.315955
C -4.062645 -1.396756 -0.386035
C 4.659181 1.074997 0.632677
C 1.376484 -1.492728 -0.440181
C -0.533826 -1.686682 -1.926210
C -4.472091 -0.059000 -0.473267
C -2.877417 -1.874546 -1.116172
C -5.609546 0.354169 0.233951
C -4.801184 -2.298630 0.404212
C -1.724037 -1.199688 -1.165615
C -6.346086 -0.536951 1.026098
C -5.929961 -1.868453 1.105493
H 3.172403 -1.904512 1.516021
H 2.057713 0.904526 -1.618512
H 5.505139 1.727119 0.915912
H -0.569086 -1.401739 -2.998195
H -0.349282 -2.773574 -1.817312
H -3.922078 0.661510 -1.088617
H -3.005038 -2.839746 -1.615590
H -4.483954 -3.341089 0.475166
H -1.576341 -0.243827 -0.654534
H -7.230722 -0.186300 1.568360
H -6.491886 -2.574494 1.719343


%chk=000258479-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258479

0 1
O 0.640528 -0.773313 -1.905789
O 0.729113 -2.347816 -0.178709
O 3.768369 2.906432 -2.170182
O 4.306712 -1.751936 3.239769
O 5.401857 3.168158 -0.597336
O 5.771773 -0.008056 3.085329
O -7.361572 1.786723 0.717285
O -5.800222 2.293974 -0.864650
N 4.390168 2.550046 -1.099872
N 4.766744 -0.695178 2.665412
N -6.298119 1.517713 0.038557
C 2.339121 -0.521458 -0.243569
C 2.984710 -0.963862 0.934760
C 2.796134 0.635131 -0.917120
C 3.902078 1.330199 -0.390836
C 4.084198 -0.232410 1.420784
C -3.763179 -1.296895 -0.165864
C 4.569689 0.922460 0.778968
C 1.167707 -1.316553 -0.741181
C -0.592552 -1.467154 -2.457082
C -4.440673 -0.073762 -0.415647
C -2.535894 -1.694117 -0.882216
C -5.601759 0.231153 0.315977
C -4.297596 -2.175023 0.820536
C -1.832794 -0.949707 -1.783311
C -6.135637 -0.631995 1.299326
C -5.464348 -1.846812 1.543750
H 2.631669 -1.858608 1.455708
H 2.304448 0.986178 -1.827046
H 5.425941 1.477098 1.171112
H -0.548706 -1.205695 -3.525711
H -0.466092 -2.553274 -2.312353
H -4.092696 0.641185 -1.165882
H -2.150388 -2.694398 -0.637997
H -3.783719 -3.122274 1.021911
H -2.135912 0.072918 -2.042543
H -7.042225 -0.345142 1.837811
H -5.851176 -2.538729 2.298203


