%chk=000192927.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192927

0 1
O 3.394432 -1.282833 0.030530
N -2.184045 1.933706 -0.391858
C -1.273271 -0.331092 -0.900382
C -2.410630 0.474379 -0.193197
C -1.538865 -1.843017 -0.686993
C -2.549010 0.086395 1.298283
C 0.082293 0.114576 -0.366602
C -1.671040 -2.219092 0.792104
C -2.792531 -1.416603 1.462797
C -1.286692 -0.039758 -2.413818
C 0.251784 1.437202 0.103558
C -0.871341 2.442798 0.111141
C 1.173902 -0.753966 -0.375061
C 1.503599 1.855961 0.569438
C 2.421036 -0.306026 0.098544
C 2.604823 0.994315 0.577825
C 4.727524 -0.937188 0.474025
H -3.376103 0.240599 -0.715899
H -0.729553 -2.435633 -1.155470
H -2.463819 -2.125333 -1.226042
H -3.374267 0.655714 1.761175
H -1.630151 0.374437 1.846261
H -0.710890 -2.031956 1.313801
H -1.866518 -3.302814 0.889501
H -3.770970 -1.694208 1.026505
H -2.853007 -1.673653 2.536900
H -0.472897 -0.557698 -2.929957
H -2.231047 -0.339569 -2.876595
H -1.168129 1.037753 -2.601575
H -2.938036 2.462030 0.062734
H -0.961387 2.876096 1.133558
H -0.601448 3.285828 -0.574024
H 1.085368 -1.775114 -0.743009
H 1.633807 2.875558 0.932909
H 3.563213 1.340906 0.943827
H 4.719297 -0.676846 1.536130
H 5.135644 -0.129901 -0.140697
H 5.271926 -1.874857 0.303136


%chk=000192927-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000192927

0 1
O 3.520075 -1.281783 -0.065595
N -2.086610 1.935320 -0.433062
C -1.271441 -0.356301 -0.886689
C -2.404777 0.501858 -0.229392
C -1.570505 -1.865314 -0.625933
C -2.656278 0.121710 1.261800
C 0.095353 0.105515 -0.334875
C -1.776593 -2.221289 0.861854
C -2.934056 -1.386088 1.453365
C -1.269666 -0.117123 -2.425578
C 0.269165 1.431527 0.166100
C -0.891911 2.413829 0.286047
C 1.220502 -0.749088 -0.388262
C 1.549105 1.841681 0.601756
C 2.494896 -0.322317 0.047263
C 2.671806 0.988487 0.551119
C 4.862402 -0.884429 0.358754
H -3.335818 0.296930 -0.797903
H -0.775244 -2.492947 -1.070673
H -2.499159 -2.117141 -1.180550
H -3.505474 0.724491 1.643613
H -1.768361 0.397902 1.864609
H -0.845572 -2.022942 1.428978
H -1.990963 -3.303128 0.963048
H -3.880532 -1.659549 0.941085
H -3.073551 -1.615291 2.527923
H -0.442537 -0.671691 -2.905831
H -2.222480 -0.463126 -2.871778
H -1.154213 0.956900 -2.644818
H -2.899268 2.548545 -0.302197
H -1.074804 2.599081 1.375931
H -0.592396 3.389166 -0.146106
H 1.137441 -1.770482 -0.771139
H 1.676498 2.861135 0.988986
H 3.646940 1.346349 0.894005
H 4.886255 -0.619215 1.434215
H 5.240884 -0.032081 -0.239323
H 5.493888 -1.768004 0.182757


