%chk=000228852.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228852

0 1
O 1.450111 2.063726 1.027439
O 1.517809 -1.050163 -0.552888
O 1.978365 -0.886306 1.656961
C 0.748367 0.905197 0.490997
C 1.299422 1.983360 -0.438270
C -0.712279 0.778777 0.862109
C 0.385592 3.011995 -1.037732
C 2.581349 1.715049 -1.175991
C 1.495817 -0.403528 0.665890
C -1.503180 0.068055 -0.242135
C -2.950476 -0.194710 0.189234
C -3.748844 -0.888694 -0.923464
C 2.110280 -2.386628 -0.609588
C -5.190559 -1.157759 -0.498811
C 1.136375 -3.404556 -0.053996
H -0.806950 0.237089 1.827894
H -1.131537 1.787567 1.061797
H 0.902096 3.975059 -1.160769
H -0.492091 3.208701 -0.405132
H 0.023346 2.695031 -2.024410
H 2.857024 2.532137 -1.853017
H 2.504997 0.793729 -1.775109
H 3.421992 1.582688 -0.476607
H -1.002385 -0.886843 -0.507736
H -1.484233 0.676436 -1.167414
H -2.966534 -0.817317 1.104968
H -3.443799 0.756865 0.466363
H -3.739270 -0.265692 -1.839247
H -3.257258 -1.841668 -1.201348
H 3.067710 -2.370161 -0.058712
H 2.281021 -2.492940 -1.696089
H -5.237862 -1.805144 0.384402
H -5.753077 -1.653117 -1.298218
H -5.719636 -0.230079 -0.252430
H 0.146906 -3.314802 -0.519746
H 0.998369 -3.271398 1.030001
H 1.491220 -4.429353 -0.215095


%chk=000228852-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000228852

0 1
O 1.457114 2.105856 1.078144
O 1.525915 -1.118492 -0.584010
O 2.181603 -0.774372 1.631824
C 0.782320 0.903488 0.468829
C 1.292431 1.998986 -0.442300
C -0.696925 0.728236 0.826659
C 0.346817 3.018881 -1.057322
C 2.607083 1.816375 -1.186752
C 1.585836 -0.382255 0.606655
C -1.535310 0.012692 -0.259438
C -3.009467 -0.170747 0.165250
C -3.863855 -0.881740 -0.908765
C 2.196726 -2.459148 -0.570725
C -5.335637 -1.067950 -0.480836
C 1.256985 -3.531379 -0.012526
H -0.761670 0.169515 1.781656
H -1.116347 1.730795 1.029054
H 0.833645 4.011074 -1.074951
H -0.594735 3.114228 -0.494664
H 0.107841 2.740125 -2.100495
H 3.079635 2.799005 -1.366780
H 2.435072 1.326159 -2.162272
H 3.313202 1.199407 -0.606989
H -1.090125 -0.974515 -0.488381
H -1.492214 0.596037 -1.201214
H -3.051064 -0.752834 1.109751
H -3.457277 0.819646 0.391858
H -3.822147 -0.299344 -1.851882
H -3.414792 -1.870535 -1.134794
H 3.119638 -2.382467 0.030638
H 2.443429 -2.633154 -1.630156
H -5.406419 -1.674537 0.441749
H -5.924898 -1.576825 -1.265687
H -5.815618 -0.092133 -0.276988
H 0.311411 -3.562734 -0.581345
H 1.032014 -3.340485 1.050055
H 1.737981 -4.524258 -0.088747


