%chk=000218302.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218302

0 1
O 4.302614 -0.801703 -1.913673
C 3.849491 -0.277979 0.434025
C 2.338694 -0.269767 0.337891
C -0.485953 -0.338654 0.123476
C 0.202942 0.895972 0.183048
C 1.617716 0.912048 0.288501
C -1.938936 -0.343892 0.014010
C 1.647693 -1.507930 0.276467
C 0.271866 -1.538711 0.173059
C -2.634375 0.887973 -0.030979
C 4.473836 0.193820 -0.897249
C 4.347953 0.586736 1.593824
C -0.543442 2.136236 0.134494
C -1.896006 2.131731 0.032469
C -2.685372 -1.551217 -0.049502
C -4.050756 0.893835 -0.137943
C -4.062477 -1.527067 -0.153375
C -4.753044 -0.293666 -0.198184
H 4.199306 -1.330802 0.607572
H 2.129678 1.872136 0.334358
H 2.214009 -2.438129 0.315342
H -0.249631 -2.496758 0.128835
H 5.574161 0.281739 -0.825647
H 4.046934 1.149030 -1.247300
H 5.426509 0.465576 1.747222
H 4.153775 1.652771 1.431487
H 3.850835 0.307589 2.531947
H 0.016934 3.069258 0.182985
H -2.463215 3.061659 -0.004413
H -2.156420 -2.504522 -0.014990
H -4.575381 1.847652 -0.171823
H -4.628893 -2.455839 -0.201698
H -5.838566 -0.292881 -0.280257
H 3.349022 -0.962244 -2.075379


%chk=000218302-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000218302

0 1
O 4.119173 -1.083520 -1.864763
C 3.901214 -0.239748 0.506352
C 2.373863 -0.248934 0.427612
C -0.501974 -0.354892 0.131830
C 0.185153 0.903458 0.296589
C 1.605980 0.927525 0.438834
C -1.960808 -0.364505 -0.013783
C 1.684316 -1.492277 0.263307
C 0.290695 -1.542083 0.122818
C -2.676150 0.888754 0.009454
C 4.507097 -0.037078 -0.915442
C 4.478480 0.818604 1.474142
C -0.574134 2.135164 0.315499
C -1.947956 2.127544 0.176778
C -2.717035 -1.565592 -0.180785
C -4.098276 0.896331 -0.133229
C -4.111920 -1.536569 -0.318921
C -4.812434 -0.296471 -0.295582
H 4.228213 -1.242102 0.847235
H 2.093323 1.901934 0.565155
H 2.263131 -2.423428 0.268911
H -0.187571 -2.519556 0.006602
H 5.607490 -0.100392 -0.866056
H 4.224708 0.970740 -1.292506
H 5.575384 0.708738 1.557624
H 4.276350 1.848789 1.125450
H 4.044364 0.712006 2.483675
H -0.032267 3.079859 0.442783
H -2.514850 3.065995 0.191361
H -2.208106 -2.534196 -0.203084
H -4.624671 1.858177 -0.113360
H -4.666549 -2.472786 -0.445727
H -5.902255 -0.280524 -0.404091
H 3.129522 -1.094965 -1.936082


