%chk=000241658.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241658

0 1
P 0.858113 -0.300363 0.495455
O 1.227737 -0.679227 1.894536
N 1.222826 -1.547289 -0.704429
N 1.722511 1.121759 -0.114334
N -0.833703 0.081378 0.282305
C 2.480819 -1.505996 -1.511647
C 2.316005 -2.522293 -0.403043
C 1.156662 2.487372 0.115259
C 2.361917 2.017609 0.899547
C -1.305249 0.115381 -1.137833
C -1.721958 -0.735942 1.169269
C -2.718228 0.727408 -1.180241
C -3.136515 -0.128973 1.151402
C -3.684668 -0.053731 -0.279876
H 3.198771 -0.683918 -1.424568
H 2.358335 -1.807637 -2.558100
H 2.078262 -3.565399 -0.640359
H 2.906573 -2.458142 0.518386
H 0.188062 2.637210 0.605169
H 1.282221 3.179199 -0.725141
H 3.364947 2.369526 0.634675
H 2.290886 1.809889 1.975114
H -1.324559 -0.894789 -1.609950
H -0.611211 0.745216 -1.739793
H -1.317667 -0.712683 2.210823
H -1.775654 -1.805019 0.860074
H -3.085537 0.740896 -2.222173
H -2.673053 1.783179 -0.847933
H -3.106557 0.886535 1.593781
H -3.806238 -0.730151 1.792495
H -4.678969 0.429438 -0.280818
H -3.837080 -1.073540 -0.681751


%chk=000241658-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241658

0 1
P 0.785625 -0.154123 0.298020
O 1.201233 -0.412273 1.834797
N 1.662061 -1.125603 -0.936410
N 1.091938 1.483729 -0.363300
N -0.885165 -0.411937 -0.006085
C 3.099621 -1.510611 -0.637350
C 2.002051 -2.554937 -0.559524
C 1.092664 2.628582 0.629722
C 2.394327 2.169358 -0.002476
C -1.487268 -0.203714 -1.340962
C -1.773567 -0.960452 1.039571
C -2.745971 0.685897 -1.225395
C -3.035040 -0.079590 1.188524
C -3.733232 0.113077 -0.179699
H 3.532383 -1.184472 0.317202
H 3.763960 -1.471431 -1.505747
H 1.868533 -3.273472 -1.373542
H 1.724096 -2.905353 0.442904
H 0.943544 2.385157 1.689570
H 0.597030 3.534484 0.268716
H 2.842102 2.739436 -0.821889
H 3.098398 1.638309 0.650656
H -1.764952 -1.188657 -1.778158
H -0.736981 0.260336 -2.002708
H -1.206205 -1.012967 1.985786
H -2.079554 -1.994857 0.763954
H -3.232275 0.763158 -2.217540
H -2.432100 1.704505 -0.924820
H -2.737582 0.905576 1.598054
H -3.726544 -0.549890 1.914692
H -4.611853 0.777445 -0.074522
H -4.113477 -0.867807 -0.535742


