%chk=000195678.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195678

0 1
O -2.528597 1.576899 1.706093
O 0.037301 1.098877 0.369083
O -3.316366 0.551414 -1.089813
O 1.301885 -0.641147 -0.299810
O -4.265577 -0.308670 1.984521
O -2.941746 -1.710687 -0.919365
O 2.308445 2.874334 -0.594518
O 4.687536 1.547654 0.549832
O 3.617670 -0.862606 1.356080
O 1.795831 -3.347647 -1.616402
C -1.193553 0.408707 0.089884
C -1.964381 0.269767 1.420318
C -2.188688 1.338013 -0.657491
C -3.173052 -0.670545 1.159046
C -2.683701 2.298148 0.441838
C -3.649558 -0.620008 -0.324411
C 1.128042 0.777390 -0.492591
C 2.303726 1.606952 0.076684
C 3.674529 0.990415 -0.283796
C 3.711620 -0.536593 -0.019731
C 2.546565 -1.192285 -0.799550
C 2.409006 -2.694519 -0.504396
C -3.333291 -2.022378 -2.274361
H -1.004636 -0.557609 -0.429702
H -1.366942 0.018356 2.312334
H -1.818670 1.819440 -1.576077
H -2.951732 -1.729798 1.437086
H -2.070729 3.206195 0.544131
H -3.753268 2.543173 0.353377
H -4.746683 -0.696481 -0.454862
H 0.891568 0.980228 -1.553437
H 2.197152 1.754120 1.176299
H 3.919483 1.219808 -1.349141
H 4.711093 -0.949187 -0.299752
H 2.611545 -1.006079 -1.893846
H -4.265334 0.683127 2.134423
H 1.824547 -2.867981 0.418991
H 3.395919 -3.190710 -0.420835
H 1.619368 3.461826 -0.209137
H 4.743582 2.520898 0.392521
H 2.741378 -0.583486 1.718910
H -3.233450 -1.135030 -2.908187
H -4.356898 -2.407943 -2.284507
H -2.617224 -2.800609 -2.560925
H 0.843986 -3.107539 -1.664009


%chk=000195678-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000195678

0 1
O -2.918430 1.820219 1.516475
O -0.004821 1.222925 0.768443
O -3.173728 0.436984 -1.184647
O 1.260221 -0.619871 0.012513
O -4.625867 -0.199147 1.692179
O -2.511655 -1.859797 -0.761180
O 2.378804 2.961240 0.255736
O 4.844097 1.515985 0.197489
O 3.900133 -1.154386 0.975091
O 0.809552 -2.950470 -1.475938
C -1.240691 0.518200 0.373714
C -2.254964 0.477680 1.509955
C -2.078743 1.306736 -0.671283
C -3.340225 -0.591943 1.139798
C -2.683365 2.435936 0.173213
C -3.439733 -0.789858 -0.401156
C 1.103746 0.847419 -0.068939
C 2.384173 1.508596 0.459867
C 3.602376 0.984297 -0.336767
C 3.664318 -0.567556 -0.344229
C 2.325879 -1.085622 -0.927302
C 2.153286 -2.606738 -0.999466
C -2.684333 -2.347041 -2.144668
H -0.987556 -0.489534 0.015455
H -1.831138 0.318801 2.511014
H -1.513684 1.658608 -1.548998
H -3.077848 -1.568657 1.579404
H -1.981277 3.280979 0.292836
H -3.648616 2.781509 -0.230057
H -4.475211 -1.055109 -0.683870
H 0.921606 1.123094 -1.135269
H 2.489723 1.262183 1.536435
H 3.462732 1.318606 -1.392804
H 4.527646 -0.887556 -0.952245
H 2.132053 -0.647092 -1.930057
H -4.603124 0.800096 1.747036
H 2.366803 -3.057553 -0.010576
H 2.849981 -3.031122 -1.741101
H 1.695153 3.364640 0.847593
H 4.730165 2.499247 0.278157
H 3.065131 -1.049195 1.504226
H -2.598968 -1.514892 -2.866538
H -3.669909 -2.839876 -2.256475
H -1.876249 -3.075296 -2.311741
H 0.150258 -2.549464 -0.850526


