%chk=000231305.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231305

0 1
S 1.143418 1.861339 -0.419278
O 1.871895 2.530858 -1.483019
O 0.649606 2.629695 0.692678
N -0.231964 1.276432 -1.347826
N -2.345416 0.233149 -1.653454
N -1.100502 -0.019460 0.442093
N 4.096201 -2.924622 1.324651
C 1.991175 0.482947 0.088906
C 2.977423 -0.080697 -0.739573
C 1.727758 -0.094386 1.343227
C -1.251645 0.484542 -0.837602
C -3.336492 -0.547586 -1.152835
C -3.260992 -1.091609 0.158951
C 3.420494 -1.776750 0.930198
C 3.694744 -1.195751 -0.337287
C 2.432471 -1.210222 1.774313
C -2.114241 -0.792471 0.910334
C -4.501492 -0.797970 -2.049730
C -4.349089 -1.939792 0.718484
H -0.380228 1.630859 -2.309290
H 3.189737 0.376089 -1.715153
H 0.958125 0.347277 1.992389
H 4.452534 -1.623507 -0.986108
H 2.218507 -1.648071 2.744070
H -1.982582 -1.177623 1.929606
H -4.380998 -0.304305 -3.029630
H -4.636142 -1.872483 -2.239333
H -5.432829 -0.415819 -1.606439
H -4.509494 -2.840273 0.107836
H -4.133829 -2.278095 1.740805
H -5.302504 -1.392043 0.756176
H 4.892649 -3.250541 0.805976
H 4.018001 -3.262311 2.267762


%chk=000231305-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231305

0 1
S 1.059644 1.647542 -0.479989
O 1.818985 2.456948 -1.672180
O 0.416862 2.426090 0.786907
N -0.276579 0.796859 -1.469702
N -2.506536 0.139198 -1.696792
N -1.278339 -0.314051 0.367991
N 4.804460 -2.674037 1.475220
C 2.171742 0.282002 0.111737
C 3.292734 -0.032823 -0.677692
C 1.891699 -0.349370 1.336760
C -1.393035 0.195166 -0.897271
C -3.604432 -0.501690 -1.196936
C -3.604631 -1.056095 0.122063
C 3.929857 -1.694467 1.021147
C 4.173700 -1.025632 -0.218011
C 2.778571 -1.339220 1.790504
C -2.400086 -0.918067 0.851391
C -4.815953 -0.577678 -2.095562
C -4.815308 -1.743248 0.712906
H -0.408280 1.266157 -2.375604
H 3.474422 0.504679 -1.613806
H 0.996732 -0.074824 1.901528
H 5.057276 -1.284875 -0.812370
H 2.583917 -1.845673 2.742781
H -2.325010 -1.314471 1.871487
H -4.594831 -0.087788 -3.055489
H -5.107827 -1.628014 -2.285876
H -5.689526 -0.080990 -1.632131
H -5.117834 -2.625534 0.116878
H -4.611194 -2.086761 1.742060
H -5.690109 -1.066560 0.752012
H 5.629365 -2.927300 0.938886
H 4.643843 -3.148675 2.359050


