%chk=000185301.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185301

0 1
O -0.287656 2.451954 1.112960
O 3.124129 -0.455382 -0.148117
O 2.208760 1.574692 0.217725
N -0.310384 -2.559130 0.285686
C -2.863652 0.322916 0.148261
C -2.323537 1.780312 0.099853
C -0.782350 1.715083 -0.002611
C -1.622070 -0.540452 0.172828
C -0.441604 0.234297 0.106973
C -3.763857 -0.007453 -1.039751
C 0.799676 -0.396049 0.133404
C -1.525125 -1.927052 0.263417
C 0.812035 -1.816032 0.223467
C 2.054054 0.375934 0.084943
C 4.434841 0.174714 -0.200684
H -3.436154 0.171668 1.096197
H -2.752018 2.353256 -0.736679
H -2.596732 2.331568 1.022633
H -0.380991 2.154588 -0.941055
H -4.640859 0.650126 -1.069462
H -3.236495 0.104808 -1.994977
H -4.131389 -1.039099 -0.991427
H -2.405587 -2.576849 0.321646
H 0.708100 2.521528 1.061775
H 1.769543 -2.358753 0.244593
H 5.090432 -0.670228 -0.437979
H 4.666127 0.615028 0.774423
H 4.446563 0.938506 -0.984944


%chk=000185301-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000185301

0 1
O -0.174197 2.607781 0.922054
O 3.145430 -0.503324 -0.074635
O 2.154431 1.588354 -0.057575
N -0.340860 -2.604882 0.446134
C -2.931535 0.282706 0.152388
C -2.384008 1.726227 0.386234
C -0.875685 1.707843 0.014494
C -1.669541 -0.565927 0.263153
C -0.499637 0.225272 0.148833
C -3.607710 0.109095 -1.235043
C 0.765256 -0.422588 0.157534
C -1.552345 -1.962103 0.408172
C 0.778271 -1.841320 0.317215
C 2.038079 0.330125 0.003816
C 4.458680 0.173638 -0.211812
H -3.666388 0.004592 0.931475
H -2.943150 2.488974 -0.180778
H -2.432463 1.990706 1.457636
H -0.706444 2.022940 -1.040261
H -4.513888 0.737903 -1.302799
H -2.921971 0.405424 -2.050156
H -3.906458 -0.940704 -1.408949
H -2.434681 -2.605588 0.507033
H 0.791649 2.582313 0.657648
H 1.733328 -2.373161 0.342962
H 5.188806 -0.645848 -0.255256
H 4.641286 0.827583 0.656900
H 4.479549 0.778467 -1.133319


