%chk=000209706.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209706

0 1
O -4.548896 1.851919 0.803210
O -5.250397 -0.325931 1.428925
O 3.505678 -0.926470 2.055424
O 5.531224 -0.100500 1.134501
N 0.243545 -0.979698 -1.812524
C 0.098350 1.429375 -1.842045
C -0.469897 0.091038 -1.438389
C -1.703685 -0.018813 -0.703856
C 0.689924 2.192090 -0.644976
C -2.135629 -1.328472 -0.340319
C 2.006150 1.607531 -0.204477
C -2.486571 1.139648 -0.353108
C -3.627993 0.916324 0.346260
C -3.356629 -1.528101 0.407956
C -4.060922 -0.413265 0.728700
C -1.350936 -2.444940 -0.727828
C -0.188403 -2.246516 -1.459757
C 1.999976 0.569744 0.766443
C 3.200198 2.087150 -0.746919
C 3.229721 0.076711 1.133648
C 4.446614 0.573105 0.579246
C 4.461686 1.575545 -0.362804
C -5.592412 1.098849 1.497668
C 0.672295 -3.380505 -1.905838
C 4.964265 -1.068677 2.074769
H 0.891723 1.281927 -2.612737
H -0.685599 2.037803 -2.335960
H -0.027433 2.197522 0.202908
H 0.817985 3.258842 -0.923653
H -2.169391 2.136681 -0.646520
H -3.672285 -2.529401 0.685258
H -1.668328 -3.446661 -0.450582
H 1.073255 0.181242 1.178552
H 3.175385 2.877374 -1.495776
H 5.383621 1.954906 -0.792169
H -6.534688 1.243195 0.952389
H -5.578458 1.395494 2.554975
H 1.515579 -3.035489 -2.528348
H 1.106396 -3.910126 -1.045299
H 0.104470 -4.109649 -2.499451
H 5.208595 -2.075343 1.711695
H 5.313919 -0.806061 3.081506


%chk=000209706-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000209706

0 1
O -4.558117 1.764350 0.886498
O -5.143098 -0.466673 1.536789
O 3.212060 -0.566468 2.511944
O 5.306313 -0.316852 1.370638
N 0.289590 -0.865017 -1.988309
C 0.039381 1.555839 -1.982153
C -0.461918 0.180392 -1.575382
C -1.655136 0.012761 -0.774394
C 0.725918 2.351520 -0.817892
C -2.022239 -1.339261 -0.388622
C 1.970231 1.671381 -0.265002
C -2.478251 1.125229 -0.365805
C -3.593594 0.848250 0.399851
C -3.196887 -1.579179 0.411099
C -3.945989 -0.481310 0.785981
C -1.189402 -2.414793 -0.830848
C -0.065069 -2.154911 -1.622742
C 1.882798 0.869239 0.911565
C 3.216197 1.812846 -0.927821
C 3.047850 0.239856 1.351951
C 4.279522 0.385626 0.680967
C 4.398652 1.173593 -0.465384
C -5.464589 0.968935 1.752666
C 0.844402 -3.248174 -2.136665
C 4.589910 -1.112137 2.401383
H 0.772961 1.405790 -2.792322
H -0.787884 2.172734 -2.385071
H -0.004301 2.513154 -0.003332
H 0.990951 3.350837 -1.213933
H -2.240429 2.148994 -0.660627
H -3.478790 -2.594811 0.700933
H -1.439794 -3.443912 -0.552296
H 0.936359 0.746853 1.446399
H 3.271201 2.431277 -1.831236
H 5.356478 1.293854 -0.977888
H -6.506091 1.151968 1.446452
H -5.271206 1.224566 2.810571
H 0.867237 -3.239979 -3.241712
H 1.880972 -3.072864 -1.796390
H 0.519796 -4.245654 -1.795548
H 4.533639 -2.166830 2.068459
H 5.102369 -0.991622 3.367927


