%chk=000269954.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269954

0 1
O 1.680484 1.750122 0.048444
O -6.117844 -1.023691 -0.790393
O -5.724297 0.634055 0.544291
N -5.364688 -0.287824 -0.174379
C 2.625979 -0.359905 -0.041391
C 3.731287 -1.350113 -0.114434
C 5.036897 -0.662224 -0.568475
C 2.866604 0.992064 -0.037863
C 5.284967 0.677891 0.146514
C 4.159522 1.700589 -0.119031
C 1.192052 -0.528520 0.051450
C 0.656269 0.789312 0.103160
C 0.301305 -1.619919 0.098653
C -0.708926 1.095726 0.198823
C -1.568033 -0.015826 0.232171
C -1.061677 -1.339942 0.183733
C 0.804371 -3.022272 0.052747
C -1.175286 2.507659 0.243318
C -3.016226 0.198289 0.336050
C -3.926468 -0.541216 -0.318988
H 3.872815 -1.822075 0.880583
H 3.476800 -2.171874 -0.813238
H 5.892288 -1.340387 -0.392073
H 4.997713 -0.492999 -1.662623
H 6.253067 1.102677 -0.177683
H 5.371311 0.503873 1.237325
H 4.278097 2.164122 -1.122387
H 4.208609 2.537944 0.607095
H -1.771656 -2.166567 0.227811
H 1.240315 -3.251136 -0.931617
H 1.589441 -3.190030 0.804895
H 0.016634 -3.764566 0.237965
H -0.336084 3.217313 0.158689
H -1.868693 2.735942 -0.579428
H -1.690505 2.737453 1.187974
H -3.336893 1.024411 0.993293
H -3.689552 -1.363056 -1.001980


%chk=000269954-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000269954

0 1
O 1.693556 1.757839 0.062404
O -6.307863 -1.252689 0.099943
O -5.733157 0.964814 0.188375
N -5.427646 -0.295207 0.123885
C 2.647521 -0.353506 -0.060168
C 3.783265 -1.352247 -0.129846
C 5.109692 -0.636729 -0.507626
C 2.893185 1.009079 0.003790
C 5.323719 0.666258 0.305749
C 4.210008 1.713398 0.019284
C 1.201940 -0.516110 -0.036919
C 0.649408 0.799151 0.036258
C 0.306054 -1.630796 -0.071493
C -0.712402 1.122486 0.080748
C -1.600763 -0.006169 0.048043
C -1.066546 -1.340107 -0.025416
C 0.805167 -3.060036 -0.163132
C -1.168677 2.566578 0.160228
C -3.037009 0.235503 0.092355
C -4.034177 -0.701738 0.072954
H 3.900189 -1.860149 0.849539
H 3.564080 -2.147197 -0.866568
H 5.959603 -1.325116 -0.343629
H 5.096784 -0.389767 -1.588040
H 6.309829 1.105239 0.067885
H 5.327388 0.424507 1.386733
H 4.389148 2.210912 -0.955781
H 4.214768 2.513166 0.783983
H -1.768276 -2.181240 -0.048228
H 1.300498 -3.252934 -1.133786
H 1.542207 -3.286265 0.628963
H -0.026413 -3.778143 -0.065865
H -0.300918 3.243893 0.160125
H -1.811463 2.838325 -0.696886
H -1.749109 2.759209 1.081125
H -3.380446 1.276007 0.147661
H -3.923145 -1.784920 0.022351


