%chk=000262638.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000262638

0 1
O 0.986423 -2.719909 0.036856
O 3.824572 -1.693288 0.000031
C -0.302642 0.601896 -0.007385
C -0.521286 -0.814429 0.016607
C -1.373752 1.476468 -0.013914
C 1.162701 0.832576 -0.021208
C -1.789118 -1.357360 0.033874
C -2.699578 0.923930 0.003660
C -2.904824 -0.455477 0.027047
C 1.824073 -0.436825 -0.005671
C 0.807501 -1.528197 0.018883
C -1.206699 2.960241 -0.038544
C 1.892512 2.008864 -0.045007
C -2.005949 -2.831575 0.058910
C 3.213454 -0.475538 -0.014952
C -3.853991 1.878702 -0.004166
C -4.279518 -1.048164 0.045813
C 3.301429 1.942220 -0.053955
C 3.968691 0.727123 -0.039429
H -0.150995 3.276757 -0.046760
H -1.674947 3.398539 -0.931921
H -1.669555 3.427775 0.842695
H 1.390370 2.977831 -0.056708
H -2.557826 -3.145429 0.955175
H -2.569520 -3.173939 -0.819437
H -1.052112 -3.394814 0.061609
H -3.829624 2.540131 0.873335
H -3.839834 2.513163 -0.901567
H -4.829819 1.366566 0.009345
H -5.074399 -0.285900 0.038069
H -4.444876 -1.693291 -0.829053
H -4.433469 -1.663317 0.944048
H 3.873373 2.872162 -0.072767
H 5.052563 0.688692 -0.046563
H 4.813776 -1.619885 -0.008250


%chk=000262638-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000262638

0 1
O 1.035191 -2.740904 0.038169
O 3.842389 -1.765626 0.002810
C -0.296083 0.628619 -0.007000
C -0.512488 -0.788056 0.016740
C -1.402184 1.505258 -0.012980
C 1.187227 0.868722 -0.021856
C -1.799376 -1.357446 0.034202
C -2.731479 0.939031 0.003204
C -2.932129 -0.471247 0.027045
C 1.843220 -0.405457 -0.005221
C 0.819016 -1.493695 0.019978
C -1.276159 3.018829 -0.035165
C 1.966727 2.044498 -0.048633
C -2.006804 -2.860396 0.059780
C 3.249704 -0.503253 -0.014241
C -3.896258 1.918657 -0.006735
C -4.309975 -1.115318 0.047005
C 3.382305 1.937299 -0.057545
C 4.028205 0.687880 -0.040578
H -0.235820 3.358157 -0.037598
H -1.767890 3.448650 -0.928816
H -1.771221 3.474413 0.843660
H 1.528467 3.042561 -0.063787
H -2.581595 -3.166205 0.955446
H -2.594123 -3.194637 -0.817427
H -1.045130 -3.392163 0.061507
H -3.860291 2.591930 0.871309
H -3.861942 2.571157 -0.900335
H -4.877758 1.426432 -0.000130
H -5.137524 -0.392863 0.042982
H -4.447663 -1.779937 -0.827372
H -4.433820 -1.753679 0.942756
H 3.987590 2.850298 -0.078320
H 5.124477 0.631351 -0.047885
H 4.830298 -1.686558 -0.006272


