%chk=000094247.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000094247

0 1
O 4.189891 -1.245804 0.739088
O 0.933186 -0.055956 -0.071540
C 3.060632 -0.319083 0.815635
C 4.470327 0.170170 0.985499
C 2.318599 -0.112247 -0.487463
C 0.004735 -0.041392 -1.186662
C -1.371590 0.002935 -0.578510
C -1.584813 -0.394821 0.747935
C -2.451779 0.430972 -1.365397
C -2.874191 -0.362916 1.286148
C -3.738853 0.455525 -0.822340
C -3.952374 0.059849 0.502538
H 2.411355 -0.472506 1.688371
H 4.995309 0.668562 0.174747
H 4.869106 0.382261 1.975156
H 2.478874 -0.961635 -1.178498
H 2.580405 0.837948 -0.985045
H 0.146648 -0.963495 -1.783089
H 0.213430 0.847357 -1.810221
H -0.736105 -0.720641 1.352796
H -2.293612 0.743874 -2.394852
H -3.037681 -0.669439 2.318012
H -4.577716 0.785487 -1.432686
H -4.955882 0.081896 0.922276


%chk=000094247-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000094247

0 1
O 4.779332 -0.505393 0.253880
O 1.040026 -0.309194 -0.120429
C 3.310464 -0.783943 0.479728
C 4.016847 0.204789 1.351796
C 2.408947 -0.330426 -0.647558
C 0.055345 -0.013542 -1.163360
C -1.332783 0.053406 -0.550082
C -1.517630 0.080906 0.852432
C -2.466395 0.110006 -1.399960
C -2.820136 0.167261 1.396681
C -3.766432 0.199795 -0.856000
C -3.947892 0.229200 0.546931
H 3.098270 -1.782712 0.881217
H 3.856798 1.276594 1.180002
H 4.303556 -0.081613 2.370435
H 2.482696 -1.036940 -1.503793
H 2.715118 0.677927 -1.001279
H 0.092680 -0.798939 -1.951850
H 0.307494 0.957539 -1.649477
H -0.638764 0.026599 1.500638
H -2.335414 0.081861 -2.489730
H -2.953165 0.185016 2.484523
H -4.634738 0.242370 -1.523293
H -4.956321 0.296331 0.970448


