%chk=000205559.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205559

0 1
O 1.427790 -1.524374 0.355701
O -1.607087 1.652837 1.280423
O -0.686059 -1.948289 0.708286
N -2.707984 0.396341 -0.248785
C -4.040962 0.871242 0.236847
C -2.838684 -0.752244 -1.188387
C -5.077970 0.143338 -0.631560
C -4.347871 -1.042932 -1.288828
C -0.207986 0.293636 -0.139513
C -1.555784 0.815386 0.391048
C 0.888650 1.295708 0.266144
C 2.249776 0.751437 -0.019675
C 0.094274 -1.100211 0.362867
C 2.456816 -0.636614 0.034599
C 3.350655 1.563524 -0.315634
C 3.699991 -1.233686 -0.197065
C 4.605877 0.991376 -0.547869
C 4.779635 -0.396967 -0.488254
H -4.093897 1.975739 0.133396
H -4.158991 0.639004 1.317911
H -2.287122 -1.641563 -0.806359
H -2.412274 -0.470888 -2.173617
H -5.488867 0.821669 -1.400896
H -5.934955 -0.199771 -0.027173
H -4.593907 -1.986158 -0.766658
H -4.661566 -1.174539 -2.337724
H -0.242025 0.241115 -1.262354
H 0.792985 1.537081 1.354681
H 0.713790 2.263355 -0.249020
H 3.229404 2.645622 -0.360918
H 3.806486 -2.315494 -0.139895
H 5.456207 1.632470 -0.775370
H 5.763155 -0.830650 -0.669249


%chk=000205559-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000205559

0 1
O 1.435915 -1.516927 0.548923
O -1.673822 1.596730 1.470246
O -0.760732 -1.945393 0.966184
N -2.726584 0.342145 -0.166552
C -4.078394 0.785744 0.277300
C -2.797653 -0.670539 -1.257652
C -5.017531 0.230414 -0.816571
C -4.296183 -1.058647 -1.287736
C -0.235559 0.273035 -0.014810
C -1.608088 0.778747 0.496376
C 0.872125 1.293254 0.349154
C 2.238288 0.755136 -0.013052
C 0.075577 -1.126839 0.548486
C 2.465661 -0.635950 0.092075
C 3.320518 1.565081 -0.428151
C 3.709777 -1.228887 -0.188834
C 4.582497 0.998097 -0.717545
C 4.776729 -0.399041 -0.596868
H -4.102067 1.883912 0.377593
H -4.299365 0.356622 1.273448
H -2.153019 -1.535911 -1.033566
H -2.485567 -0.222963 -2.223902
H -5.097810 0.950020 -1.652435
H -6.032949 0.037993 -0.432448
H -4.479289 -1.878472 -0.569652
H -4.617482 -1.397621 -2.286778
H -0.268014 0.152999 -1.118508
H 0.794205 1.509978 1.432087
H 0.670159 2.248307 -0.165523
H 3.170743 2.647482 -0.518832
H 3.826041 -2.311358 -0.081584
H 5.409954 1.641048 -1.035299
H 5.753415 -0.841696 -0.818477


