%chk=000244654.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244654

0 1
P -2.019504 -0.496387 0.310794
O -1.085421 0.893105 0.129768
O -1.714222 -1.274033 1.535356
N -3.619877 0.183283 0.209499
N -1.755239 -1.317843 -1.206960
C -4.070357 1.277179 1.135083
C -1.622063 -2.815378 -1.225370
C -3.876202 1.544804 -0.351573
C -2.835279 -2.133504 -1.841596
C -5.445863 1.108365 1.720724
C -0.517579 -3.359513 -2.089948
C 0.294023 0.733670 0.087121
C 1.010127 0.067415 1.053153
C 0.914945 1.416785 -1.005556
C 2.435874 0.052059 0.957195
C 2.281393 1.409349 -1.094533
C 3.076865 0.726217 -0.116950
C 3.236959 -0.629870 1.928655
C 4.504338 0.707051 -0.199482
C 4.605234 -0.630870 1.823197
C 5.248447 0.045948 0.746035
H -3.354732 1.725586 1.847760
H -1.753165 -3.388776 -0.287885
H -4.739947 1.605368 -1.022666
H -3.060824 2.188713 -0.698313
H -2.910277 -2.014362 -2.928870
H -3.828613 -2.235527 -1.394793
H -5.898964 2.080791 1.949731
H -6.124957 0.572523 1.041440
H -5.406013 0.521225 2.649704
H -0.304567 -2.707781 -2.950447
H 0.420081 -3.442060 -1.521677
H -0.772358 -4.353903 -2.476049
H 0.524344 -0.449489 1.886336
H 0.279352 1.917499 -1.732666
H 2.787172 1.920859 -1.913463
H 2.735295 -1.144632 2.747475
H 4.986657 1.226964 -1.025852
H 5.221016 -1.147043 2.558419
H 6.335002 0.027412 0.690401


%chk=000244654-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244654

0 1
P -2.276890 -0.602014 0.324982
O -1.175166 0.732046 -0.076632
O -1.932228 -1.367208 1.685408
N -3.834008 0.179445 0.270977
N -2.253904 -1.539438 -1.188862
C -4.099733 1.524397 0.916605
C -1.158874 -2.602163 -1.336054
C -4.133877 1.376314 -0.599924
C -2.590989 -3.024771 -1.081934
C -5.356423 1.627604 1.755881
C -0.508936 -2.679870 -2.701524
C 0.238231 0.640771 -0.008553
C 0.915956 -0.105101 0.959658
C 0.943799 1.411420 -0.986452
C 2.349801 -0.114535 0.968697
C 2.337705 1.421492 -0.980209
C 3.079582 0.661726 -0.014952
C 3.089494 -0.871634 1.938366
C 4.512846 0.649212 0.007710
C 4.486465 -0.864748 1.935532
C 5.205964 -0.098908 0.962642
H -3.214143 2.042656 1.310384
H -0.484383 -2.712023 -0.475050
H -5.097935 1.313239 -1.115482
H -3.307414 1.806247 -1.176109
H -3.207528 -3.385758 -1.911024
H -2.836904 -3.421830 -0.089056
H -5.666064 2.684479 1.855421
H -6.180798 1.058861 1.293107
H -5.183123 1.219077 2.767135
H -1.256521 -2.524933 -3.498095
H 0.271509 -1.904852 -2.804764
H -0.036525 -3.669158 -2.846867
H 0.353912 -0.673628 1.708979
H 0.365316 1.978982 -1.721493
H 2.883185 2.012754 -1.725248
H 2.538694 -1.456209 2.684632
H 5.059874 1.238403 -0.738399
H 5.039716 -1.446531 2.681133
H 6.301419 -0.102614 0.972628


