%chk=000270939.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270939

0 1
O 0.643028 -1.919407 -1.032756
O -4.756128 -0.638518 -0.240456
O -1.193510 1.675382 -1.081588
N 0.874427 -0.245131 1.427451
N -0.421088 -0.618129 1.277080
C 3.957256 0.630356 0.217330
C 3.244864 -0.276571 1.230271
C 3.153140 1.897504 -0.103152
C 1.873509 -0.718296 0.753142
C 3.929004 2.845093 -1.012667
C 1.922869 -1.626092 -0.462200
C -2.764862 -0.276835 0.924125
C -1.339613 0.207760 0.873284
C -3.350426 -0.377692 -0.487300
C -1.118268 1.618881 0.351827
C -0.021527 -3.073945 -0.473369
C -5.553630 -0.634783 -1.436298
C -0.104304 1.017485 -1.759818
H 4.172794 0.074879 -0.715299
H 4.947739 0.912874 0.628525
H 3.864710 -1.169729 1.445969
H 3.154880 0.256599 2.204336
H 2.876961 2.415126 0.836980
H 2.184263 1.623256 -0.585952
H 2.431990 -1.108727 -1.304754
H 2.470904 -2.556698 -0.225781
H 4.860510 3.184547 -0.544981
H 3.338930 3.739435 -1.246155
H 4.194014 2.371404 -1.964481
H -2.846414 -1.261653 1.435118
H -3.385974 0.411979 1.537019
H -3.233719 0.562684 -1.059197
H -2.923406 -1.217728 -1.059229
H -1.943141 2.298423 0.646503
H -0.158093 2.044029 0.699027
H 0.511143 -3.981884 -0.766383
H -0.112840 -2.993314 0.615237
H -1.011559 -3.025247 -0.942243
H -6.561058 -0.840398 -1.054059
H -5.230247 -1.425834 -2.118793
H -5.517258 0.345158 -1.921775
H 0.868048 1.387339 -1.396971
H -0.181359 -0.071965 -1.627105
H -0.267160 1.299184 -2.805062


%chk=000270939-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270939

0 1
O 0.436546 -1.997173 -1.037497
O -4.875558 -0.846299 -0.280816
O -1.447435 2.085767 -0.916832
N 0.769235 -0.203716 1.390447
N -0.552368 -0.539788 1.204418
C 4.066886 0.476018 0.216912
C 3.173306 -0.355306 1.181507
C 3.532386 1.902141 -0.044984
C 1.771003 -0.640101 0.662022
C 4.447448 2.717811 -0.983083
C 1.704021 -1.382802 -0.680640
C -2.917806 -0.126700 0.926662
C -1.477200 0.347073 0.897274
C -3.499134 -0.374303 -0.479323
C -1.177375 1.790885 0.508103
C 0.127070 -3.186555 -0.229719
C -5.557309 -1.093059 -1.547676
C -0.532628 1.384644 -1.825059
H 4.191165 -0.056505 -0.748427
H 5.080926 0.545199 0.659194
H 3.678879 -1.323034 1.385974
H 3.073886 0.174812 2.145490
H 3.420352 2.429675 0.923428
H 2.513218 1.842946 -0.478512
H 1.915778 -0.666600 -1.498588
H 2.521190 -2.141698 -0.690490
H 5.461334 2.825741 -0.553564
H 4.045312 3.732400 -1.157420
H 4.552460 2.222319 -1.967030
H -2.979418 -1.067588 1.499776
H -3.556318 0.625951 1.428888
H -3.488848 0.558985 -1.079873
H -2.900946 -1.148024 -1.010894
H -1.856504 2.475861 1.045028
H -0.124310 2.039934 0.757162
H 0.957729 -3.922193 -0.280339
H -0.080793 -2.906606 0.819900
H -0.779676 -3.622570 -0.677371
H -6.572468 -1.437472 -1.293362
H -5.041897 -1.877053 -2.144188
H -5.625235 -0.169168 -2.161888
H 0.520562 1.686284 -1.635155
H -0.616256 0.283356 -1.733108
H -0.821814 1.697316 -2.840947


