%chk=000220373.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220373

0 1
O -1.774832 -2.391814 -0.980382
O -3.830909 0.754221 -0.376729
O -1.811246 -1.583331 1.142166
O -2.142033 1.945400 0.550853
O 1.820971 -1.771132 -0.440911
O 3.935385 -1.922566 -0.053024
N 2.909911 -1.272839 -0.192831
C -0.213527 0.344471 -0.954206
C -1.687110 -0.070268 -0.798215
C 0.511416 0.499327 0.391439
C 1.902965 1.018802 0.191257
C -1.768271 -1.392757 -0.047718
C -2.510227 1.002034 -0.104821
C 3.014829 0.192742 -0.068872
C 2.119215 2.408685 0.279144
C 4.306654 0.743837 -0.215900
C 3.390612 2.951795 0.121496
C 4.492170 2.116809 -0.125306
C -1.683667 -3.780900 -0.509857
C -4.839574 1.644995 0.204872
C -0.307513 -4.047880 0.054420
C -4.894154 2.940549 -0.575288
H 0.308957 -0.428011 -1.565432
H -0.161932 1.293650 -1.524418
H -2.122590 -0.228486 -1.829252
H 0.518310 -0.475653 0.932642
H -0.072155 1.183768 1.054599
H 1.267566 3.064448 0.477582
H 5.156047 0.074935 -0.398605
H 3.535356 4.031647 0.192509
H 5.487292 2.545048 -0.241686
H -1.885707 -4.320029 -1.453673
H -2.491936 -3.946148 0.223000
H -4.597018 1.796235 1.271807
H -5.747285 1.023773 0.090244
H -0.096209 -5.120084 0.126400
H -0.189015 -3.614541 1.058829
H 0.484042 -3.595461 -0.568117
H -3.975674 3.530087 -0.433751
H -5.003269 2.760716 -1.652498
H -5.736947 3.565126 -0.254869


%chk=000220373-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000220373

0 1
O -1.778091 -2.380729 -1.079123
O -3.817655 0.786446 -0.250065
O -2.020950 -1.473198 1.059557
O -2.016241 2.194997 0.202339
O 2.094452 -1.844580 -0.603935
O 4.264886 -1.915296 0.071405
N 3.177260 -1.268402 -0.190075
C -0.146976 0.352784 -1.015044
C -1.657733 -0.000939 -0.909181
C 0.594953 0.374059 0.351278
C 1.994891 0.948527 0.208205
C -1.860247 -1.330433 -0.173248
C -2.470092 1.117753 -0.248574
C 3.189097 0.207219 -0.027498
C 2.150997 2.356026 0.334762
C 4.463857 0.820190 -0.116206
C 3.406668 2.987223 0.225819
C 4.572951 2.216058 0.001137
C -1.807022 -3.768261 -0.506638
C -4.760189 1.764959 0.380430
C -0.427910 -4.171767 0.020097
C -5.216819 2.808929 -0.641717
H 0.341169 -0.379224 -1.680765
H -0.071968 1.351749 -1.483017
H -2.055063 -0.135539 -1.932547
H 0.618875 -0.645433 0.767691
H 0.028165 1.015622 1.047291
H 1.253359 2.953971 0.529671
H 5.341615 0.188514 -0.276229
H 3.478705 4.075799 0.323622
H 5.552618 2.697411 -0.079078
H -2.123252 -4.383545 -1.363814
H -2.572566 -3.797668 0.288906
H -4.250769 2.234207 1.239984
H -5.590679 1.131314 0.729229
H -0.441877 -5.240895 0.302814
H -0.156554 -3.583592 0.912079
H 0.351785 -4.022329 -0.745118
H -4.369420 3.433665 -0.970484
H -5.670275 2.325218 -1.523976
H -5.975058 3.470389 -0.183084


