%chk=000196305.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196305

0 1
O 0.992759 0.276638 -1.009907
O -2.518803 2.096008 1.756860
O -2.123630 3.627750 0.174065
O -5.209156 -0.484435 -1.446168
N -0.579426 0.535341 0.621991
N 0.547353 -1.948519 1.570521
N 7.384427 0.066594 -0.824527
N -5.481531 -1.695072 0.441763
C 2.766118 -1.278584 0.536389
C 1.422747 -0.823288 1.137498
C 3.728863 -0.102422 0.327402
C -1.493231 1.281466 -0.262718
C 5.117345 -0.592037 -0.097821
C -2.637636 0.429061 -0.837516
C 0.618852 0.012260 0.117679
C -3.449955 -0.318354 0.221748
C 6.046114 0.590743 -0.419683
C -2.049386 2.475963 0.515005
C -4.758414 -0.809693 -0.362053
H 3.230337 -2.034220 1.198269
H 2.593407 -1.780952 -0.438789
H 1.621467 -0.173966 2.034972
H 3.308725 0.571626 -0.452672
H 3.806694 0.503603 1.249205
H -0.888731 1.699186 -1.131577
H 5.041213 -1.243662 -0.993387
H 5.562526 -1.224599 0.692818
H -2.212352 -0.296764 -1.564933
H -3.314555 1.071763 -1.448585
H -0.982268 0.175525 1.490514
H -2.857432 -1.162141 0.631504
H -3.661197 0.350075 1.089930
H 5.632918 1.167560 -1.278541
H 6.091301 1.290072 0.442520
H 0.444256 -2.634607 0.825061
H 0.959149 -2.433128 2.364491
H 7.995354 0.830876 -1.095199
H 7.832182 -0.412831 -0.050237
H -2.868537 2.865686 2.282560
H -6.368471 -2.050168 0.117722
H -5.181197 -2.001053 1.346825


%chk=000196305-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000196305

0 1
O 0.901302 1.255725 -0.457232
O -2.872714 1.763105 2.546976
O -3.713768 3.132063 0.870300
O -4.371703 -0.670024 -2.325220
N -0.763135 0.991163 1.150948
N 0.699765 -0.439612 2.813250
N 6.779285 -1.277618 -1.626463
N -3.898091 -2.605632 -1.142853
C 2.522390 -0.742835 1.045639
C 1.487456 0.202169 1.722713
C 3.646458 -0.021917 0.265890
C -1.782854 1.687445 0.363265
C 4.679393 -1.008924 -0.320588
C -2.427918 0.794744 -0.744138
C 0.524923 0.854837 0.690991
C -3.156368 -0.446663 -0.192081
C 5.806175 -0.298282 -1.098059
C -2.871296 2.291107 1.242553
C -3.850654 -1.229490 -1.317073
H 2.979327 -1.358582 1.848784
H 1.991256 -1.439429 0.364765
H 2.046069 1.044544 2.180152
H 3.189581 0.580775 -0.538765
H 4.160851 0.689263 0.947908
H -1.291656 2.525595 -0.169894
H 4.184662 -1.723436 -1.006649
H 5.126967 -1.612643 0.499307
H -1.612413 0.490639 -1.423294
H -3.137924 1.402459 -1.331642
H -0.930350 0.649496 2.109874
H -2.453532 -1.094159 0.365904
H -3.946151 -0.136324 0.522176
H 5.361719 0.239550 -1.957377
H 6.261027 0.479599 -0.434336
H 0.447477 -1.412642 2.598859
H 1.147877 -0.374697 3.732721
H 7.442869 -0.892615 -2.305646
H 7.253626 -1.820685 -0.897192
H -3.607551 2.184591 3.069737
H -4.380140 -3.167436 -1.844818
H -3.464035 -3.067922 -0.346399


