%chk=000185853.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185853

0 1
O -4.345653 0.051249 0.431043
O 1.186699 -2.911208 0.062444
O -0.989535 -3.837216 -0.095639
N -1.714159 2.576656 -0.257323
C -0.501455 1.791127 0.167693
C -0.716202 0.291449 0.030064
C 0.699185 2.210042 -0.712523
C -1.986024 -0.267952 -0.084515
C -3.200253 0.623967 -0.211912
C -2.949779 2.025283 0.379601
C 0.463857 -0.524699 0.060803
C 1.927110 1.443679 -0.315041
C 1.797655 0.090711 0.079499
C 0.244053 -1.889419 0.025082
C -2.193097 -1.671563 -0.138155
C -1.065718 -2.449811 -0.070341
C -1.570739 4.022111 0.093204
C 3.189946 2.043583 -0.341239
C 2.940209 -0.630032 0.455084
C 0.434907 -4.166109 -0.032400
C 4.322919 1.312650 0.032267
C 4.197553 -0.019511 0.433352
H -0.242898 1.986912 1.246899
H 0.862069 3.303745 -0.645601
H 0.462683 2.013264 -1.782917
H -3.529713 0.685268 -1.279375
H -3.811891 2.682407 0.129370
H -2.903926 1.976057 1.487397
H -3.196137 -2.085501 -0.233772
H -2.437233 4.571770 -0.310826
H -0.675074 4.430747 -0.405091
H -1.494255 4.233721 1.169827
H 3.295852 3.080573 -0.653183
H 2.848747 -1.675228 0.761554
H -4.152035 -0.178824 1.362387
H 0.610526 -4.732688 0.891223
H 0.712173 -4.654821 -0.975921
H 5.303328 1.785601 0.010114
H 5.078904 -0.586589 0.726667


%chk=000185853-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185853

0 1
O -4.395448 0.047132 0.618227
O 1.189594 -2.964271 0.106946
O -1.007520 -3.888653 -0.038797
N -1.733538 2.569063 -0.279805
C -0.511623 1.818536 0.114097
C -0.722714 0.300892 0.031926
C 0.710894 2.200935 -0.750780
C -2.018075 -0.264409 -0.054657
C -3.250230 0.630253 -0.112218
C -2.929568 2.039500 0.411242
C 0.456418 -0.529602 0.074327
C 1.943970 1.444124 -0.287649
C 1.805960 0.082887 0.122762
C 0.225744 -1.915967 0.042774
C -2.209813 -1.677094 -0.098943
C -1.068478 -2.468285 -0.048305
C -1.603162 4.031701 -0.103909
C 3.217547 2.053029 -0.271229
C 2.961210 -0.633377 0.539728
C 0.429168 -4.202670 -0.208627
C 4.361927 1.333749 0.142020
C 4.227867 -0.013144 0.550021
H -0.249527 2.060428 1.183539
H 0.906845 3.285235 -0.697055
H 0.471273 1.958946 -1.806478
H -3.626034 0.705152 -1.147127
H -3.789928 2.700100 0.209033
H -2.792020 1.996730 1.525716
H -3.214982 -2.098654 -0.167006
H -2.565423 4.509621 -0.355648
H -0.842295 4.443716 -0.786766
H -1.330741 4.325726 0.941166
H 3.313931 3.099285 -0.586219
H 2.865596 -1.675589 0.853627
H -4.112545 -0.123933 1.554016
H 0.715801 -4.988348 0.505989
H 0.621146 -4.481677 -1.262887
H 5.344086 1.819397 0.149996
H 5.107289 -0.579065 0.876753


