%chk=000272161.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272161

0 1
O 0.823875 -0.835561 0.088548
O -2.013236 2.151302 -1.518577
O -5.259236 -2.404719 0.351014
O -5.394474 -0.255598 0.544597
N -0.676966 1.470308 0.193736
N -4.761673 -1.289115 0.408950
C 0.800304 3.145423 1.306736
C 0.514297 1.659290 1.073275
C 0.897378 3.875940 -0.034253
C -0.429673 3.779891 -0.783503
C -1.090453 2.418461 -0.765058
C -1.294690 0.172480 0.221682
C -0.524702 -1.034215 0.165895
C -2.685595 0.071125 0.287056
C -3.295010 -1.197469 0.323191
C -1.144649 -2.291429 0.206523
C -2.533794 -2.373338 0.278489
C 1.706083 -2.008638 0.018330
C 3.078105 -1.407400 -0.099661
C 3.318960 -0.397972 -1.043198
C 4.118095 -1.866051 0.721266
C 4.599575 0.146985 -1.166859
C 5.398386 -1.321702 0.586646
C 5.640362 -0.316110 -0.355244
H 1.740260 3.254770 1.881088
H 0.006402 3.598961 1.933383
H 1.398469 1.159890 0.602169
H 0.328751 1.142537 2.041203
H 1.713712 3.442620 -0.646215
H 1.166129 4.938791 0.121220
H -0.302644 4.083346 -1.845992
H -1.164565 4.504874 -0.365806
H -3.311230 0.976838 0.291744
H -0.561039 -3.207513 0.167616
H -3.036147 -3.347752 0.299457
H 1.433797 -2.597728 -0.877658
H 1.562988 -2.605541 0.935744
H 2.501399 -0.038845 -1.670353
H 3.936392 -2.643663 1.461089
H 4.787294 0.930769 -1.899750
H 6.209203 -1.681137 1.219237
H 6.639362 0.105795 -0.456553


%chk=000272161-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000272161

0 1
O 0.853084 -0.755481 0.196657
O -1.445656 1.865007 -1.889460
O -5.297005 -2.507524 0.359088
O -5.480797 -0.233353 0.426620
N -0.718310 1.513442 0.297384
N -4.781939 -1.319945 0.373755
C 0.379322 3.384579 1.569383
C 0.093871 1.876205 1.499606
C 0.925404 3.876458 0.215096
C -0.147496 3.662167 -0.871604
C -0.809132 2.280728 -0.874641
C -1.330252 0.208663 0.303304
C -0.520491 -0.970501 0.262914
C -2.726876 0.083290 0.327618
C -3.312970 -1.201538 0.335242
C -1.127834 -2.254627 0.282112
C -2.526986 -2.373147 0.316306
C 1.742264 -1.934453 -0.017063
C 3.143313 -1.415148 -0.237332
C 3.421604 -0.563243 -1.336974
C 4.193749 -1.785587 0.636485
C 4.733037 -0.091042 -1.556988
C 5.509967 -1.319965 0.412183
C 5.781514 -0.471396 -0.684805
H 1.106622 3.563027 2.383040
H -0.545136 3.939288 1.823078
H 1.044469 1.309564 1.470123
H -0.467425 1.547872 2.394298
H 1.844505 3.312211 -0.038996
H 1.203647 4.945247 0.264425
H 0.253927 3.816326 -1.888282
H -0.964767 4.400900 -0.747490
H -3.362049 0.971870 0.329868
H -0.517602 -3.161142 0.264798
H -3.019567 -3.348732 0.326474
H 1.367177 -2.485292 -0.902943
H 1.693132 -2.596019 0.869363
H 2.608464 -0.265383 -2.009006
H 3.985241 -2.437613 1.493710
H 4.940357 0.566899 -2.408021
H 6.316992 -1.615080 1.091578
H 6.800431 -0.108632 -0.859700


