%chk=000227887.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227887

0 1
O -1.233505 -0.000408 0.026440
O -2.549194 0.005269 -1.805567
C -3.546490 -0.003723 0.459751
C 2.460701 0.004514 -0.563831
C 3.629736 0.004596 0.430322
C 1.112721 0.001677 0.165315
C 4.981277 0.007215 -0.296059
C -4.397536 -1.277137 0.295509
C -4.399447 1.269568 0.304720
C -0.042618 0.003595 -0.829377
C 6.152300 0.006765 0.696752
C -2.459645 0.000924 -0.600272
C -3.616319 -2.539788 0.643298
C -3.620121 2.530846 0.661619
C 7.500335 0.008410 -0.020555
H -3.066174 -0.007027 1.472871
H 2.533840 -0.878351 -1.228933
H 2.531583 0.889459 -1.226404
H 3.558349 0.886631 1.095946
H 3.560465 -0.879401 1.093570
H 1.029272 -0.880774 0.831393
H 1.028088 0.880372 0.836185
H 5.054997 -0.873962 -0.962100
H 5.053165 0.890782 -0.959118
H -5.293764 -1.201512 0.942981
H -4.778611 -1.341606 -0.745354
H -4.780637 1.340984 -0.735648
H -5.295551 1.187922 0.951634
H -0.082383 0.906887 -1.460641
H -0.080484 -0.895783 -1.466317
H 6.082245 0.889583 1.362051
H 6.083333 -0.877670 1.360018
H -2.743265 -2.671335 -0.008485
H -4.241212 -3.433659 0.530936
H -3.250001 -2.522436 1.676468
H -3.253758 2.506578 1.694634
H -2.747276 2.668411 0.010798
H -4.246358 3.424566 0.555723
H 7.619009 -0.873975 -0.659652
H 8.329830 0.008375 0.695436
H 7.617703 0.892119 -0.658060


%chk=000227887-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227887

0 1
O -1.259049 -0.002394 0.205293
O -2.558389 0.003680 -1.727901
C -3.663161 -0.004462 0.486492
C 2.511262 0.004471 -0.476276
C 3.740789 0.004554 0.460003
C 1.171949 0.001072 0.297906
C 5.086286 0.007504 -0.299829
C -4.515983 -1.286260 0.261815
C -4.515309 1.279507 0.271706
C -0.029826 0.001502 -0.646478
C 6.315368 0.007794 0.637761
C -2.480951 -0.001125 -0.475436
C -3.756137 -2.598549 0.549770
C -3.754460 2.589216 0.568696
C 7.656832 0.010714 -0.126925
H -3.259591 -0.008500 1.516858
H 2.558897 -0.882463 -1.141924
H 2.556324 0.893970 -1.138674
H 3.694016 0.891373 1.125960
H 3.696302 -0.884504 1.123123
H 1.119155 -0.889591 0.953360
H 1.116798 0.888812 0.957123
H 5.135091 -0.879426 -0.965833
H 5.132692 0.896505 -0.963239
H -5.406281 -1.219206 0.917757
H -4.881709 -1.284217 -0.783295
H -4.881705 1.285344 -0.773157
H -5.405185 1.208171 0.927742
H -0.054990 0.897573 -1.294392
H -0.052315 -0.891570 -1.298617
H 6.265556 0.894079 1.302915
H 6.267930 -0.880536 1.300355
H -2.893376 -2.720071 -0.130707
H -4.416391 -3.473791 0.411035
H -3.373791 -2.620627 1.587254
H -3.371515 2.603668 1.606094
H -2.892025 2.715011 -0.111401
H -4.414220 3.465853 0.436588
H 7.744872 -0.881047 -0.775878
H 8.518443 0.010933 0.565727
H 7.742397 0.904532 -0.773373


