%chk=000197411.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000197411

0 1
O 2.911990 -1.727853 -0.452432
O 3.988729 0.217372 -0.726915
O -3.049758 -2.200309 -0.189602
N 1.460489 -0.558343 1.556593
C 1.773679 0.184051 0.347200
C 0.713794 0.800732 -0.598554
C 1.554357 1.688520 0.301378
C -0.732960 0.581746 -0.337689
C 3.016630 -0.363014 -0.313064
C -1.244984 -0.719001 -0.374325
C -1.581039 1.672432 -0.079594
C -2.618236 -0.897373 -0.145113
C -2.944205 1.462589 0.142011
C -3.484732 0.174138 0.116523
H 0.932208 0.811864 -1.679189
H 2.326925 2.322983 -0.139353
H 1.102320 2.186687 1.159028
H 1.304791 -1.546515 1.349785
H 0.629315 -0.194673 2.017447
H -0.616177 -1.580192 -0.589693
H -1.174286 2.680995 -0.061619
H 3.726085 -2.133659 -0.857445
H -3.597423 2.314125 0.338185
H -4.542595 0.013266 0.290169
H -4.023418 -2.277968 -0.034732


%chk=000197411-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000197411

0 1
O 3.293614 -1.524635 0.700558
O 3.531453 -0.294920 -1.260288
O -3.518172 -1.851550 -1.346627
N 1.502815 0.147974 1.754633
C 1.828931 0.348809 0.378211
C 0.680575 0.585296 -0.791079
C 1.593823 1.695753 -0.287420
C -0.748136 0.437516 -0.417930
C 2.955803 -0.463364 -0.157073
C -1.500025 -0.599376 -1.030043
C -1.387079 1.259069 0.555759
C -2.850949 -0.804733 -0.685081
C -2.740717 1.044176 0.894023
C -3.485959 0.013250 0.282737
H 0.968776 0.146185 -1.752085
H 2.369932 2.044447 -0.973872
H 1.172516 2.479443 0.351152
H 1.572433 -0.820452 2.074797
H 0.678873 0.648193 2.094235
H -1.043957 -1.253968 -1.780094
H -0.850698 2.099880 1.010315
H 4.029277 -2.048610 0.284331
H -3.225669 1.690148 1.634186
H -4.539126 -0.146306 0.547512
H -4.456836 -1.919624 -1.041857


