%chk=000194138.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194138

0 1
O 2.532061 -0.450416 0.088254
O -2.189050 -1.625191 1.082198
O -4.497906 -0.974846 -0.472084
O 2.608757 2.084163 -0.377841
C -2.443535 -0.347906 0.466659
C -1.104037 0.315619 0.248587
C 0.073184 -0.456710 0.288441
C 1.304305 0.156216 0.082472
C -3.170833 -0.578056 -0.874345
C -1.049623 1.686709 0.005819
C 1.354498 1.562351 -0.175852
C 0.187156 2.317347 -0.212532
C 2.573953 -1.878693 0.423383
C 4.057902 -2.185010 0.386531
H -3.091582 0.237184 1.163203
H -0.013440 -1.524224 0.499188
H -3.235464 0.341509 -1.480237
H -2.699603 -1.388377 -1.456895
H -1.957847 2.285544 -0.013562
H 0.223660 3.386269 -0.402709
H 2.130036 -2.018130 1.424007
H 2.000899 -2.432014 -0.339584
H -3.045034 -2.105169 1.178356
H 4.256071 -3.236682 0.619098
H 4.485068 -1.963504 -0.602006
H 4.609074 -1.563130 1.106817
H -5.010506 -1.270421 -1.248464
H 2.568938 3.060967 -0.533803


%chk=000194138-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000194138

0 1
O 2.564780 -0.416964 0.090937
O -2.245034 -1.574989 1.199855
O -4.366794 -1.350678 -0.491199
O 2.647198 2.212033 -0.423814
C -2.453218 -0.304032 0.498977
C -1.113260 0.384796 0.292694
C 0.083831 -0.371026 0.310747
C 1.333029 0.244496 0.075510
C -3.147754 -0.593189 -0.848170
C -1.058117 1.771632 0.037850
C 1.381675 1.646078 -0.194654
C 0.187048 2.395456 -0.208513
C 2.554310 -1.861614 0.397761
C 4.008542 -2.323320 0.369446
H -3.127209 0.348620 1.095213
H 0.006229 -1.435178 0.545192
H -3.401638 0.353582 -1.364578
H -2.475454 -1.200885 -1.487585
H -1.974240 2.373760 0.043263
H 0.230271 3.475337 -0.403703
H 2.095942 -2.023762 1.394853
H 1.944829 -2.396068 -0.360185
H -3.096010 -2.081389 1.105529
H 4.068664 -3.404023 0.593795
H 4.454092 -2.143990 -0.623859
H 4.603995 -1.774411 1.118601
H -4.806306 -1.699269 -1.304726
H 2.557702 3.184396 -0.586139


