%chk=000298902.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298902

0 1
O -4.843347 -0.693851 -0.087596
C 0.664875 0.532335 -0.008562
C -0.741294 0.162951 0.026815
C 1.760996 -0.423499 -0.071053
C 0.988457 1.898982 0.017634
C -1.727997 1.159617 -0.220903
C 3.081402 0.019251 0.203940
C -0.030918 2.896924 -0.192970
C 2.341545 2.329477 0.252889
C -1.330362 2.540015 -0.364519
C 3.343756 1.421363 0.399894
C -1.198656 -1.135727 0.383651
C 1.596028 -1.780466 -0.476371
C -3.099941 0.818452 -0.267911
C 4.158936 -0.913660 0.226777
C -3.484668 -0.488022 0.005811
C -2.535714 -1.475886 0.369319
C 2.652966 -2.664410 -0.480720
C 3.947524 -2.235179 -0.094830
C -5.351364 -2.020593 0.190214
H 0.276051 3.942374 -0.232769
H 2.534752 3.399089 0.331334
H -2.101723 3.279003 -0.576490
H 4.361335 1.731510 0.631219
H -0.472041 -1.885668 0.708560
H 0.617993 -2.117923 -0.823160
H -3.850818 1.569488 -0.501833
H 5.154205 -0.559001 0.490914
H -2.851782 -2.475773 0.647263
H 2.508783 -3.697684 -0.791765
H 4.764492 -2.954053 -0.076378
H -4.936803 -2.743875 -0.517484
H -6.428807 -1.885031 0.026637
H -5.145665 -2.297130 1.228044


%chk=000298902-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298902

0 1
O -4.942086 -0.683499 -0.093056
C 0.676190 0.520415 -0.012429
C -0.743335 0.157686 0.008560
C 1.783756 -0.438559 -0.061018
C 1.007285 1.917296 0.015129
C -1.744360 1.181874 -0.231918
C 3.131161 0.022728 0.214851
C -0.017341 2.915825 -0.174863
C 2.365709 2.346012 0.233156
C -1.339262 2.561036 -0.357926
C 3.386998 1.428539 0.396086
C -1.235644 -1.143018 0.349461
C 1.639406 -1.810031 -0.460736
C -3.126769 0.845930 -0.272585
C 4.217452 -0.908734 0.236571
C -3.558136 -0.462892 -0.017156
C -2.600522 -1.458691 0.340454
C 2.723697 -2.696483 -0.466567
C 4.021433 -2.256777 -0.075350
C -5.435817 -2.032141 0.196022
H 0.285050 3.969589 -0.191913
H 2.566139 3.422400 0.289998
H -2.106614 3.320484 -0.545860
H 4.411037 1.755544 0.610119
H -0.538719 -1.908321 0.697161
H 0.676793 -2.162003 -0.837623
H -3.874442 1.620190 -0.473387
H 5.220611 -0.535147 0.474977
H -2.917997 -2.463747 0.633600
H 2.575949 -3.731040 -0.795879
H 4.860857 -2.960331 -0.062498
H -5.006187 -2.777756 -0.500992
H -6.524570 -1.974198 0.051138
H -5.215527 -2.328779 1.240072


