%chk=000242660.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242660

0 1
S 2.723619 0.957101 0.056507
O 6.322077 -0.435978 0.568673
O 5.454347 1.631880 0.494899
N -2.200776 0.680175 -0.657881
N -0.346496 2.007789 -0.324324
N -1.087613 -1.556891 -0.561903
N 1.364741 -1.339368 -0.203342
N 0.299724 -3.453803 -0.314246
C -3.619500 0.305746 -0.805985
C -4.348185 0.361615 0.545510
C -5.832150 0.010388 0.379965
C -1.121705 -0.189413 -0.511549
C 0.041281 0.658340 -0.313932
C -1.667555 2.008100 -0.516920
C -6.569356 0.064643 1.715340
C 1.278753 0.002069 -0.166835
C 0.177200 -2.074839 -0.379662
C 4.009005 -0.313003 0.206129
C 5.268541 0.442243 0.429213
H -4.094416 0.990596 -1.544392
H -3.671617 -0.726514 -1.232491
H -4.242158 1.365023 1.001735
H -3.869345 -0.340006 1.259723
H -6.310805 0.705182 -0.338186
H -5.934253 -1.002041 -0.060085
H -2.304978 2.879034 -0.580353
H -7.628535 -0.190734 1.593386
H -6.145728 -0.639977 2.441140
H -6.523665 1.063226 2.165376
H 4.060544 -0.960296 -0.699246
H 3.792654 -1.026812 1.034876
H -0.479063 -4.024737 -0.608779
H 1.219719 -3.863933 -0.371495
H 7.188893 0.028495 0.721533


%chk=000242660-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242660

0 1
S 2.786761 1.149320 -0.012420
O 6.271276 -0.847987 0.538086
O 5.779402 1.416565 0.341626
N -2.200872 0.858212 -0.702943
N -0.339780 2.200076 -0.500288
N -1.141123 -1.358235 -0.433490
N 1.295848 -1.175876 -0.103225
N 0.217431 -3.253808 -0.153819
C -3.611901 0.454915 -0.836073
C -4.330719 0.320814 0.525949
C -5.802476 -0.118346 0.357345
C -1.122708 -0.002077 -0.497810
C 0.025256 0.845502 -0.378767
C -1.668973 2.163675 -0.688411
C -6.533558 -0.261841 1.709649
C 1.259002 0.178204 -0.174388
C 0.110734 -1.882843 -0.234552
C 3.978984 -0.291474 0.214008
C 5.390393 0.231834 0.362412
H -4.124450 1.200527 -1.472207
H -3.629101 -0.514823 -1.365611
H -4.287277 1.288637 1.063892
H -3.787951 -0.418704 1.145199
H -6.338849 0.617154 -0.276828
H -5.836059 -1.084495 -0.186052
H -2.300782 3.038781 -0.828383
H -7.582055 -0.581273 1.568380
H -6.034748 -1.011636 2.351610
H -6.543591 0.697553 2.259886
H 3.906348 -0.966944 -0.652931
H 3.687569 -0.874646 1.101644
H -0.619059 -3.822640 -0.246044
H 1.131250 -3.671836 -0.007297
H 7.198977 -0.498986 0.634251


