%chk=000221608.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221608

0 1
O -1.878576 -0.704051 0.639928
O 4.324499 2.315942 -0.496653
O -5.365578 -1.054926 0.776617
O -3.759148 -2.476054 1.104827
N 2.228427 -2.137435 -0.206166
N 2.377770 1.209165 0.037114
N 1.032116 1.258053 -0.001188
N 2.385836 3.346202 -1.154661
N -4.186467 -1.369408 0.836295
C 3.236531 -1.090448 -0.571862
C 3.185302 0.031319 0.485424
C 2.839135 -3.198325 0.648350
C 1.603316 -2.738675 -1.420385
C 3.105076 2.326272 -0.544244
C -1.158677 0.457661 0.332119
C 0.277329 0.254643 0.368825
C -2.018488 1.512973 0.072463
C -3.228466 -0.316381 0.557032
C -3.348475 1.017089 0.216945
H 3.020448 -0.672543 -1.579636
H 4.273592 -1.485609 -0.636215
H 4.220208 0.396249 0.701142
H 2.767044 -0.339720 1.448948
H 3.287745 -2.738888 1.542695
H 3.608417 -3.807449 0.150890
H 2.040555 -3.874594 0.997638
H 0.830718 -3.460497 -1.104855
H 2.300885 -3.257802 -2.093422
H 1.087863 -1.948816 -1.990846
H 0.608269 -0.756179 0.690896
H -1.739325 2.517981 -0.187373
H -4.264157 1.572710 0.086803
H 2.884975 4.187121 -1.411100
H 1.380402 3.412620 -1.088846


%chk=000221608-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221608

0 1
O -1.806353 -0.750146 0.493522
O 4.438770 2.427046 -0.574677
O -5.369845 -1.020458 0.792066
O -3.725961 -2.632337 0.901486
N 2.155441 -2.169057 -0.283926
N 2.448501 1.246288 -0.141206
N 1.079269 1.362819 -0.091973
N 2.375470 3.506711 -0.833540
N -4.126804 -1.409131 0.756695
C 3.171738 -1.159396 -0.682882
C 3.226124 0.055005 0.285494
C 2.617584 -3.041029 0.819601
C 1.632691 -2.952149 -1.426329
C 3.175469 2.433212 -0.528356
C -1.087022 0.448063 0.268449
C 0.342078 0.292279 0.182500
C -1.994050 1.521472 0.182534
C -3.155780 -0.384178 0.537970
C -3.307689 0.990284 0.352265
H 2.933650 -0.794651 -1.698187
H 4.190212 -1.612435 -0.737054
H 4.261258 0.421874 0.375682
H 2.866179 -0.245042 1.289142
H 2.946057 -2.433590 1.681206
H 3.468933 -3.699992 0.519574
H 1.784967 -3.681679 1.158127
H 0.827594 -3.620819 -1.074790
H 2.411697 -3.579090 -1.923437
H 1.201954 -2.270683 -2.181252
H 0.765082 -0.730680 0.289297
H -1.720827 2.561152 0.021431
H -4.255124 1.522717 0.346494
H 2.824445 4.372640 -1.117119
H 1.363393 3.413179 -0.751304


