%chk=000257383.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257383

0 1
O 0.950578 -1.626258 0.250139
O 0.109967 3.068050 0.319822
O 3.528357 0.003988 0.633670
N 2.043667 1.807008 0.514964
C 0.046548 0.588570 0.219445
C 1.082601 -0.300526 0.316046
C -1.373966 0.324362 0.031685
C 0.603080 1.975223 0.340830
C 2.414815 0.446217 0.510715
C -1.837267 -1.000893 -0.075800
C -2.302669 1.381041 -0.045186
C 2.180920 -2.452761 0.373277
C -3.197962 -1.260033 -0.255908
C -3.659510 1.113045 -0.225129
C -4.112928 -0.206673 -0.331192
C 1.636217 -3.856043 0.252949
H 2.695560 2.577950 0.625327
H -1.134542 -1.834487 -0.018880
H -1.966044 2.418387 0.035692
H 2.864583 -2.166460 -0.444483
H 2.639803 -2.233322 1.352749
H -3.544954 -2.288765 -0.337775
H -4.369007 1.937616 -0.283197
H -5.172260 -0.410310 -0.471490
H 2.441818 -4.599026 0.326089
H 0.904038 -4.077741 1.043078
H 1.122955 -4.012654 -0.707036


%chk=000257383-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257383

0 1
O 0.993218 -1.635630 0.257776
O 0.087612 3.130882 0.317386
O 3.567575 0.018718 0.645800
N 2.039990 1.829908 0.516880
C 0.034966 0.621888 0.220108
C 1.097911 -0.271977 0.321299
C -1.397258 0.352148 0.030315
C 0.632521 1.999300 0.344817
C 2.402746 0.477960 0.513525
C -1.884172 -0.988225 -0.075035
C -2.342109 1.421223 -0.053829
C 2.210001 -2.514080 0.374154
C -3.257759 -1.242351 -0.256264
C -3.713602 1.155355 -0.235171
C -4.182347 -0.174995 -0.337595
C 1.703043 -3.945514 0.252724
H 2.691592 2.606613 0.628413
H -1.180480 -1.820786 -0.013868
H -1.989434 2.452658 0.023973
H 2.915260 -2.242792 -0.429917
H 2.693339 -2.314720 1.345860
H -3.609260 -2.277373 -0.334314
H -4.419745 1.990841 -0.296853
H -5.249926 -0.377069 -0.478507
H 2.555469 -4.644680 0.331303
H 0.986217 -4.181819 1.057316
H 1.209030 -4.109977 -0.719895


