%chk=000210186.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210186

1 1
O 0.530080 1.157772 -0.621557
O 0.514093 -1.051592 -1.034755
N 3.652374 0.132427 0.382187
N -1.926707 -2.347585 -0.669660
C 2.842931 1.380402 0.021494
C 4.379125 -0.396976 -0.833829
C 4.672497 0.518616 1.435258
C 2.759308 -0.947302 0.941119
C 1.868839 1.220462 -1.151745
C -0.140477 -0.073288 -0.689581
C -1.518023 0.036861 -0.300555
C -2.381844 -1.100604 -0.313432
C -2.058814 1.299191 0.089510
C -3.749813 -0.944646 0.081191
C -3.373795 1.427776 0.464219
C -4.224630 0.289528 0.459110
H 2.252420 1.707245 0.918310
H 3.550893 2.215337 -0.198753
H 5.028619 0.369853 -1.293507
H 5.017896 -1.265562 -0.583498
H 3.666224 -0.743892 -1.612086
H 4.187786 0.914767 2.348149
H 5.284101 -0.349430 1.749338
H 5.374292 1.291170 1.069613
H 2.148885 -0.584303 1.787286
H 2.038540 -1.324688 0.169657
H 3.334107 -1.822453 1.291308
H 1.841024 2.146575 -1.767809
H 2.074790 0.347799 -1.805006
H -1.393297 2.168024 0.079602
H -4.409697 -1.811425 0.076530
H -3.781614 2.393153 0.760953
H -5.270220 0.410274 0.758995
H -2.558918 -3.128736 -0.748174
H -0.987376 -2.485450 -1.032281


%chk=000210186-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210186

1 1
O 0.588699 1.299208 -0.434851
O 0.602537 -0.888397 -1.247717
N 3.572873 0.145425 0.445031
N -1.711636 -2.295112 -1.092920
C 3.064660 1.512926 -0.088066
C 3.818776 -0.837406 -0.702399
C 4.890253 0.408491 1.177624
C 2.579838 -0.472752 1.433011
C 1.895500 1.511201 -1.078709
C -0.070223 0.066027 -0.723665
C -1.464831 0.044301 -0.334139
C -2.248758 -1.160571 -0.529843
C -2.084779 1.203143 0.239975
C -3.621573 -1.146235 -0.121384
C -3.425907 1.189694 0.625837
C -4.191917 -0.000916 0.441917
H 2.806311 2.113612 0.801048
H 3.934056 1.978818 -0.586779
H 4.480950 -0.364522 -1.444630
H 4.305135 -1.735266 -0.290447
H 2.849748 -1.105034 -1.152255
H 4.720172 1.151839 1.971798
H 5.247637 -0.533049 1.621252
H 5.634942 0.787501 0.461170
H 2.347759 0.262118 2.218133
H 1.670531 -0.762357 0.893240
H 3.045861 -1.365770 1.878006
H 1.846599 2.531827 -1.498075
H 2.033774 0.794055 -1.904996
H -1.480188 2.105194 0.364254
H -4.225405 -2.049817 -0.262421
H -3.889251 2.079930 1.059842
H -5.245496 -0.018898 0.741101
H -2.293224 -3.117711 -1.238156
H -0.739823 -2.282194 -1.414185


