%chk=000261367.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261367

0 1
O 0.977011 -1.620461 0.058776
O -0.795641 2.073043 0.356652
O 5.333106 0.417589 0.004860
O -6.661223 -0.035144 -0.177613
O 5.665904 -1.846390 -0.092468
C -1.045109 -0.287155 0.096918
C 1.186326 0.805991 0.145157
C 1.752704 -0.472700 0.076435
C -0.414041 -1.483929 0.051887
C -0.282502 0.982775 0.208292
C -2.513952 -0.193187 0.050348
C 2.055526 1.919538 0.163385
C 3.137609 -0.700449 0.027042
C -3.232193 -0.778986 -1.011173
C -3.205133 0.499928 1.056321
C -0.982524 -2.850174 -0.002876
C 3.947367 0.429222 0.047056
C 3.428735 1.745253 0.113970
C -4.619038 -0.705092 -1.052355
C -4.599672 0.585803 1.036181
C -5.291768 -0.021397 -0.018332
C 6.127370 -0.740915 -0.063952
C -7.460727 0.681926 0.792968
C 7.538251 -0.277761 -0.089068
H 1.614505 2.921733 0.218447
H 3.534344 -1.717666 -0.024606
H -2.696071 -1.283385 -1.814142
H -2.644916 0.991619 1.854348
H -1.174338 -3.166239 -1.041482
H -1.940505 -2.911058 0.541790
H -0.298451 -3.597522 0.434911
H 4.114820 2.589607 0.125917
H -5.192476 -1.148690 -1.862311
H -5.117439 1.125685 1.821381
H -8.476873 0.518804 0.411155
H -7.205538 1.745701 0.784706
H -7.338854 0.240459 1.785946
H 7.628341 0.821947 -0.048850
H 8.045835 -0.619454 -1.006902
H 8.100231 -0.688868 0.766481


%chk=000261367-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000261367

0 1
O 1.004322 -1.637634 -0.011160
O -0.819812 2.080588 0.465191
O 5.426177 0.477441 0.007344
O -6.784817 -0.027445 -0.199235
O 5.812489 -1.839414 -0.202093
C -1.060204 -0.317461 0.122985
C 1.197801 0.792641 0.214988
C 1.793822 -0.480485 0.062338
C -0.398835 -1.534306 0.024150
C -0.277744 0.939384 0.285772
C -2.547242 -0.237355 0.072073
C 2.058452 1.921351 0.293367
C 3.189994 -0.679567 -0.013059
C -3.286602 -0.898243 -0.950880
C -3.269053 0.538928 1.014685
C -0.994645 -2.913977 -0.023886
C 4.002690 0.467306 0.067602
C 3.446897 1.768604 0.219777
C -4.687391 -0.812386 -1.015024
C -4.676409 0.631569 0.968132
C -5.390492 -0.049376 -0.049191
C 6.244250 -0.672563 -0.123583
C -7.556944 0.767457 0.759234
C 7.697399 -0.257208 -0.153547
H 1.593753 2.904962 0.411099
H 3.602187 -1.681350 -0.127125
H -2.753308 -1.462269 -1.724564
H -2.723643 1.085022 1.788495
H -0.954466 -3.334659 -1.046228
H -2.043891 -2.901258 0.304452
H -0.411796 -3.588033 0.628256
H 4.124695 2.624544 0.275823
H -5.254442 -1.311752 -1.806320
H -5.196157 1.237760 1.715863
H -8.606272 0.646273 0.452779
H -7.275683 1.837467 0.713609
H -7.424088 0.392528 1.792857
H 7.808454 0.832318 -0.066325
H 8.155107 -0.604658 -1.096186
H 8.234450 -0.754745 0.672737


