%chk=000213174.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213174

0 1
O -1.677234 0.729051 -0.132828
O 1.180236 0.240330 0.375154
O -0.848529 -0.646178 -1.772277
O 1.596109 -1.365827 1.946090
O -1.530975 -3.338423 -1.143701
O 2.344343 -3.815079 0.459335
N -2.218041 -1.443811 -0.014278
N 1.489036 -1.837767 -0.384311
C 0.014468 2.319426 0.644728
C 1.164359 3.241149 0.117207
C -0.794961 1.817021 -0.576745
C 0.620868 1.115169 1.405136
C 0.633017 4.430876 -0.711870
C -0.922027 3.050533 1.615278
C 2.047067 3.755480 1.260263
C 1.712060 5.024729 -1.614927
C -1.494882 -0.487542 -0.764911
C 1.466473 -1.064107 0.788048
C -2.198296 -2.860673 -0.260392
C 1.852978 -3.231298 -0.471990
C -3.060596 -3.627523 0.692512
C 1.536768 -3.810057 -1.813382
H 1.803089 2.599407 -0.545978
H -0.133558 1.452430 -1.387803
H -1.501369 2.571968 -0.961664
H 1.447878 1.400355 2.080315
H -0.142594 0.549147 1.966082
H -0.227092 4.125339 -1.337660
H 0.241703 5.215253 -0.034401
H -0.416067 3.316772 2.550293
H -1.304143 3.982051 1.182510
H -1.791935 2.431113 1.869281
H 2.469569 2.931726 1.850452
H 2.892824 4.333025 0.866767
H 1.498208 4.410749 1.944445
H 1.323313 5.872677 -2.190304
H 2.570171 5.388337 -1.037092
H 2.091663 4.287983 -2.332637
H -2.755991 -1.080143 0.783432
H 1.147821 -1.362143 -1.244711
H -2.676908 -3.588108 1.724655
H -3.079271 -4.695659 0.409130
H -4.104355 -3.284216 0.707697
H 0.447242 -3.764225 -2.026039
H 1.825024 -4.872203 -1.852449
H 2.046740 -3.298514 -2.639958


%chk=000213174-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213174

0 1
O -1.726389 0.683091 0.009812
O 1.150800 0.170365 0.326144
O -0.835785 -0.711073 -1.678371
O 2.126373 -1.304667 1.880998
O -1.671267 -3.436980 -1.136302
O 2.855641 -3.775936 0.377266
N -2.379479 -1.475961 -0.042856
N 1.624797 -1.913866 -0.381272
C 0.051561 2.312409 0.723592
C 1.174439 3.239384 0.096848
C -0.873585 1.829365 -0.431842
C 0.699166 1.079355 1.403104
C 0.606365 4.305986 -0.887312
C -0.789748 3.047436 1.800272
C 2.049583 3.916034 1.181926
C 1.692759 5.163874 -1.575044
C -1.562255 -0.525160 -0.681116
C 1.705129 -1.070401 0.733454
C -2.424310 -2.870842 -0.310107
C 2.131699 -3.239172 -0.493510
C -3.463876 -3.601752 0.532309
C 1.683614 -3.915388 -1.783613
H 1.827681 2.562148 -0.494659
H -0.288153 1.495711 -1.304753
H -1.588908 2.615316 -0.721215
H 1.555211 1.355310 2.041100
H -0.037862 0.539674 2.026537
H 0.021876 3.805949 -1.683154
H -0.097303 4.974466 -0.349323
H -0.194844 3.258752 2.706543
H -1.172650 4.010473 1.417900
H -1.657511 2.431651 2.099439
H 2.410199 3.200688 1.942098
H 2.946216 4.371939 0.728222
H 1.495684 4.717749 1.705358
H 1.247032 5.799261 -2.362144
H 2.207033 5.831904 -0.862511
H 2.458311 4.523460 -2.053108
H -2.964502 -1.107373 0.711989
H 1.035973 -1.557208 -1.147821
H -3.185401 -3.578187 1.602493
H -3.509613 -4.650391 0.206563
H -4.464697 -3.144934 0.427386
H 0.579621 -3.952443 -1.833730
H 2.092822 -4.935224 -1.813403
H 2.042758 -3.356193 -2.667687


