%chk=000209916.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209916

0 1
O 0.017694 -0.832234 0.065850
O 1.471222 -0.021249 -1.560923
O -0.819603 1.927695 0.613765
O -3.438114 1.738732 1.892620
O 1.674282 -3.026539 0.551326
O 3.618967 1.464679 1.054575
O 2.716934 3.309021 -0.967845
N -1.822122 -2.071206 -1.973750
N -5.448176 0.182012 0.604970
N 3.717064 -1.369588 1.846958
C -1.197390 -0.242088 -0.467138
C -2.200520 -1.403687 -0.698284
C -1.596735 0.725918 0.667008
C -4.002892 -0.145568 0.584315
C -3.090132 1.110451 0.651201
C -3.662230 -0.918554 -0.699725
C 1.011181 -1.196387 -0.895646
C 2.149295 -1.840089 -0.055624
C 2.677344 -0.798364 0.963463
C 3.154213 0.445793 0.162260
C 2.004917 1.013333 -0.700177
C 2.478576 2.096053 -1.683394
H -0.962087 0.303210 -1.406954
H -2.049032 -2.143473 0.135830
H -1.297471 0.303410 1.661067
H -3.796765 -0.783404 1.486848
H -3.309201 1.831573 -0.165898
H -4.350333 -1.786961 -0.782917
H -3.873233 -0.299411 -1.591716
H 0.601493 -1.822379 -1.716231
H 2.952029 -2.212597 -0.736011
H 1.823680 -0.493778 1.634922
H 4.062860 0.226686 -0.442523
H 1.174525 1.391212 -0.050371
H -2.165969 -1.562774 -2.782795
H -2.201697 -3.012439 -2.019506
H -5.696557 0.834950 -0.131864
H -5.691984 0.625387 1.491377
H 1.684586 2.360994 -2.407029
H 3.387097 1.797852 -2.234758
H -0.901434 2.377964 -0.254781
H -2.760413 2.416020 2.128066
H 4.277306 -0.625119 2.261831
H 4.348301 -1.982812 1.339889
H 1.068888 -2.812628 1.302169
H 2.919181 1.709783 1.704136
H 3.409754 3.155097 -0.271990


%chk=000209916-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000209916

0 1
O -0.023872 -0.883180 -0.231678
O 1.347660 0.874278 -1.200491
O -1.192737 1.844738 -1.197784
O -3.574113 2.546344 0.087362
O 1.792330 -2.858229 -0.856084
O 4.037424 0.904836 1.468779
O 2.795439 3.418807 1.119712
N -2.088568 -2.925504 -0.308212
N -5.559162 0.473620 0.585858
N 4.246596 -1.793249 0.322594
C -1.457288 -0.570897 -0.570853
C -2.296023 -1.574893 0.247522
C -1.783486 0.899067 -0.243100
C -4.104798 0.225743 0.602990
C -3.297662 1.167207 -0.318642
C -3.803941 -1.230135 0.190509
C 0.973941 -0.554831 -1.230043
C 2.201716 -1.452350 -0.964329
C 3.001969 -1.028237 0.291403
C 3.313300 0.478224 0.240449
C 2.033198 1.317904 0.052059
C 2.311564 2.823922 -0.125401
H -1.606885 -0.761154 -1.654732
H -1.961439 -1.474679 1.310446
H -1.429928 1.118054 0.789168
H -3.755833 0.396947 1.641500
H -3.616926 1.010092 -1.375276
H -4.365246 -1.911002 0.856921
H -4.163914 -1.415514 -0.842260
H 0.573649 -0.700291 -2.250142
H 2.877770 -1.416265 -1.834147
H 2.331760 -1.195651 1.180064
H 4.034243 0.677949 -0.570677
H 1.345202 1.162141 0.910110
H -2.642158 -3.657370 0.146164
H -1.106659 -3.189881 -0.428605
H -5.984597 0.237512 -0.320795
H -5.773295 1.447072 0.837480
H 1.373456 3.351807 -0.364343
H 3.027175 2.971908 -0.961526
H -0.203092 1.676615 -1.275962
H -2.937123 3.122254 -0.412163
H 4.910846 -1.504781 1.044407
H 4.118341 -2.804571 0.237194
H 1.067318 -2.880673 -0.174877
H 3.477758 0.675648 2.257752
H 3.603388 2.905144 1.398279


