%chk=000181756.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181756

0 1
O 5.357249 1.762207 0.619006
O 5.716565 -1.067399 0.819012
O -2.673280 0.656229 -1.090642
O -3.246481 2.013423 0.624326
C 2.157969 0.614202 -0.632844
C 4.408062 0.833002 0.261419
C 3.235047 1.420769 -0.222158
C 4.511635 -0.585664 0.330312
C 2.270130 -0.779301 -0.564061
C 3.442706 -1.378086 -0.085118
C 0.938475 1.262228 -1.141433
C -0.297545 0.830130 -0.868086
C -1.523326 1.504309 -1.393668
C -4.549032 0.016134 0.175533
C -3.465418 1.008819 -0.013755
C -5.456315 0.222519 1.227958
C -4.677866 -1.101401 -0.662592
C -6.490587 -0.691648 1.437819
C -5.715623 -2.011176 -0.446397
C -6.619858 -1.806531 0.601669
C 6.613175 1.283490 1.161868
C 5.855937 -2.503123 0.941611
H 3.171606 2.507882 -0.263664
H 1.445932 -1.410315 -0.891139
H 3.503337 -2.462498 -0.044604
H 1.114601 2.146317 -1.760258
H -0.492730 -0.040786 -0.237534
H -1.674712 2.512751 -0.954765
H -1.556716 1.554437 -2.498797
H -5.343932 1.097991 1.873712
H -3.965369 -1.250911 -1.478167
H -7.196265 -0.535687 2.252713
H -5.819972 -2.879832 -1.094861
H -7.428678 -2.518437 0.767789
H 7.145710 2.221108 1.356080
H 7.132291 0.667860 0.419482
H 6.433965 0.719959 2.083429
H 5.792595 -2.976948 -0.042168
H 5.111105 -2.901941 1.636212
H 6.867810 -2.592882 1.356660


%chk=000181756-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000181756

0 1
O 5.395706 0.502433 -1.562990
O 5.761290 -1.385576 0.542875
O -2.685372 1.284748 -0.316315
O -3.274123 0.809989 1.891669
C 2.058554 0.682631 0.079911
C 4.400977 0.246712 -0.603328
C 3.172912 0.913639 -0.772939
C 4.535103 -0.706586 0.454178
C 2.220197 -0.248575 1.141056
C 3.437874 -0.930536 1.323507
C 0.805144 1.414519 -0.175951
C -0.350540 1.357286 0.548299
C -1.569014 2.163108 0.204893
C -4.542639 -0.186167 0.057743
C -3.467823 0.658997 0.657348
C -5.446966 -0.836660 0.937218
C -4.675038 -0.352599 -1.345429
C -6.478129 -1.645105 0.416828
C -5.707711 -1.164035 -1.861156
C -6.610393 -1.810135 -0.983007
C 6.750203 0.843937 -1.080441
C 5.885760 -2.430343 1.563728
H 3.101632 1.624755 -1.603727
H 1.391753 -0.452232 1.827051
H 3.525539 -1.651770 2.141806
H 0.825029 2.080924 -1.052578
H -0.441257 0.715068 1.433079
H -1.964838 2.697971 1.087309
H -1.386611 2.860600 -0.627873
H -5.322535 -0.694527 2.015852
H -3.969144 0.151853 -2.010837
H -7.176327 -2.145539 1.096486
H -5.809786 -1.294079 -2.944028
H -7.411714 -2.439255 -1.386891
H 7.327577 1.056607 -1.993055
H 7.196768 0.004357 -0.523763
H 6.714488 1.746951 -0.440250
H 5.128551 -3.223722 1.415592
H 5.793317 -2.011044 2.584244
H 6.893782 -2.847400 1.423788


