%chk=000206671.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206671

0 1
O 0.299953 -0.166584 0.076876
O -5.031055 0.478250 -0.083529
O -0.895706 2.189457 0.763920
N -1.032185 -0.152928 0.547012
N -2.965081 1.310920 0.320062
C -3.241422 -1.168304 0.114090
C -1.759451 -1.153568 -0.295363
C -3.859226 0.226692 0.081884
C -4.036619 -2.110450 -0.783545
C -1.554451 1.205844 0.513524
C 1.226776 0.012207 1.216283
C 2.566883 -0.103560 0.550118
C 3.433989 -1.155746 0.878839
C 2.952303 0.851294 -0.402867
C 4.686760 -1.241205 0.265320
C 4.203253 0.755986 -1.018166
C 5.072151 -0.287439 -0.682775
H -3.321187 -1.520669 1.181196
H -1.290173 -2.147466 -0.105900
H -1.636843 -0.953868 -1.383597
H -5.112524 -2.060629 -0.548288
H -3.939800 -1.854994 -1.846614
H -3.719785 -3.152358 -0.658924
H -3.367961 2.259299 0.374087
H 1.025760 -0.766456 1.969069
H 1.049370 1.015948 1.650996
H 3.136033 -1.904825 1.610086
H 2.269110 1.661401 -0.662561
H 5.362968 -2.054099 0.524633
H 4.501106 1.496743 -1.758685
H 6.048052 -0.357993 -1.159982


%chk=000206671-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206671

0 1
O 0.345487 -0.435081 -0.265076
O -5.071235 0.677330 0.046030
O -0.643942 2.122840 0.169300
N -1.049394 -0.202226 0.080587
N -2.845575 1.329906 0.046693
C -3.349467 -1.095850 0.195448
C -1.949311 -1.250066 -0.439983
C -3.855440 0.351613 0.075513
C -4.361921 -2.091467 -0.402589
C -1.431016 1.143125 0.085317
C 1.204456 -0.364112 0.980062
C 2.627168 -0.240089 0.496893
C 3.562959 -1.284027 0.695406
C 3.034325 0.945939 -0.168394
C 4.895741 -1.144419 0.244445
C 4.362132 1.082251 -0.625377
C 5.296590 0.038810 -0.417208
H -3.253246 -1.287904 1.285207
H -1.515705 -2.226779 -0.171139
H -2.015459 -1.196731 -1.547308
H -5.364502 -1.908235 0.016310
H -4.431018 -1.974904 -1.499067
H -4.065060 -3.131450 -0.178968
H -3.145251 2.310833 0.049592
H 1.037148 -1.278661 1.579362
H 0.885508 0.529072 1.544654
H 3.250414 -2.205553 1.202087
H 2.300301 1.744295 -0.327366
H 5.616120 -1.954121 0.405530
H 4.671367 1.998820 -1.139916
H 6.328824 0.147743 -0.768848


