%chk=000229852.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229852

0 1
O -2.192546 -1.281645 0.155673
O -5.535070 1.067769 -0.668322
O 4.554941 -1.146864 -1.338717
O 5.718167 0.635751 -0.288782
O -3.441664 -3.077452 0.012804
C -2.075215 0.143223 0.398345
C -0.606800 0.454582 0.095187
C 0.321182 -0.201734 1.128058
C -3.038567 0.954668 -0.494025
C 1.762876 0.059312 0.788274
C -4.400658 0.340845 -0.448954
C 2.396108 -0.777834 -0.170834
C 2.450705 1.107714 1.401691
C 3.711403 -0.493342 -0.450306
C -4.586421 -0.974112 -0.202007
C -3.457474 -1.873027 -0.003567
C 4.409956 0.579562 0.181341
C 3.805460 1.394073 1.110083
C 5.846663 -0.458653 -1.253549
C -5.416788 2.467874 -1.024653
H -2.328992 0.289820 1.473100
H -0.440315 1.547932 0.070777
H -0.349840 0.075269 -0.917658
H 0.117637 -1.298194 1.154036
H 0.084037 0.158663 2.148593
H -2.676084 0.959654 -1.547646
H -3.032276 2.012914 -0.168233
H 1.864559 -1.597369 -0.647962
H 1.942594 1.733119 2.134119
H -5.575775 -1.432389 -0.175082
H 4.331334 2.209775 1.596581
H 6.058309 -0.018967 -2.236746
H 6.582514 -1.172046 -0.859813
H -4.969402 3.036105 -0.204779
H -6.472703 2.746748 -1.160458
H -4.863754 2.580057 -1.960966


%chk=000229852-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000229852

0 1
O -2.227433 -1.349289 0.147470
O -5.594757 1.076670 -0.748824
O 4.581388 -1.000370 -1.497177
O 5.810196 0.659935 -0.265440
O -3.659715 -3.140734 0.314687
C -2.103395 0.124161 0.341875
C -0.627374 0.459776 0.099811
C 0.317542 -0.220871 1.126733
C -3.066552 0.886440 -0.589888
C 1.785672 0.034745 0.817596
C -4.466434 0.323976 -0.434822
C 2.419485 -0.696076 -0.234186
C 2.522939 1.008344 1.537707
C 3.756610 -0.407652 -0.506364
C -4.661004 -0.969742 -0.023593
C -3.544199 -1.903318 0.174279
C 4.478239 0.565604 0.216771
C 3.887976 1.293438 1.250689
C 5.919228 -0.371456 -1.332058
C -5.444034 2.490144 -1.132535
H -2.382016 0.339040 1.396396
H -0.494591 1.559379 0.143909
H -0.354491 0.137174 -0.923207
H 0.099815 -1.304501 1.118252
H 0.076226 0.151951 2.141140
H -2.731544 0.798038 -1.643401
H -3.028117 1.958816 -0.323078
H 1.878849 -1.463265 -0.796866
H 2.030578 1.556540 2.349124
H -5.668332 -1.381191 0.070970
H 4.450596 2.041666 1.814668
H 6.203971 0.119296 -2.278237
H 6.642714 -1.143318 -1.014297
H -5.087441 3.100775 -0.282039
H -6.457642 2.809285 -1.414212
H -4.764856 2.608392 -1.996248


