%chk=000213752.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213752

0 1
O 2.066403 1.406733 0.245337
N -1.979154 -1.169222 -0.047001
N -2.121484 1.285857 -0.165748
N -0.246393 2.639311 -0.074781
N -4.059691 -0.060850 -0.184528
C 0.068099 0.188352 0.092031
C -0.614570 -1.080593 0.078055
C 1.487848 0.152497 0.233785
C -0.759890 1.365536 -0.043969
C 0.135005 -2.296821 0.193609
C 2.203279 -1.023548 0.347572
C 1.498861 -2.255987 0.323814
C -2.679698 0.010055 -0.141872
C 3.505171 1.504388 0.389157
H -0.417367 -3.235997 0.176181
H 3.279694 -1.040620 0.454333
H 2.073818 -3.179895 0.413295
H 0.743670 2.814784 0.025853
H -0.865436 3.432122 -0.156457
H 3.816382 1.077151 1.347632
H 3.664467 2.589311 0.368384
H 4.000345 1.015249 -0.455641
H -4.592321 0.765829 -0.403010
H -4.501839 -0.957943 -0.314530


%chk=000213752-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213752

0 1
O 2.101784 1.463166 0.237760
N -2.019990 -1.182318 -0.050699
N -2.151260 1.264567 -0.163131
N -0.284652 2.636751 -0.037039
N -4.062099 -0.068564 -0.293600
C 0.047616 0.187519 0.093611
C -0.644091 -1.086591 0.079653
C 1.475274 0.192179 0.231035
C -0.804761 1.367471 -0.036542
C 0.112417 -2.295529 0.203522
C 2.200515 -1.003950 0.350922
C 1.500591 -2.245217 0.335635
C -2.691202 -0.007876 -0.164654
C 3.559985 1.512148 0.374855
H -0.435818 -3.241077 0.190190
H 3.288141 -1.001332 0.455294
H 2.072874 -3.174834 0.429977
H 0.724526 2.760033 0.056476
H -0.936356 3.412855 -0.131363
H 3.882989 1.066209 1.334084
H 3.817410 2.581603 0.355486
H 4.054603 0.992444 -0.466926
H -4.589783 0.794384 -0.382055
H -4.513515 -0.978344 -0.300992