%chk=000221758.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221758

0 1
O -2.360287 -1.360506 0.822879
O -2.070075 -2.778564 -0.936678
C -1.647007 0.656774 -1.129601
C 2.979522 0.608362 0.994464
C -0.660421 0.122517 -0.113403
C 1.561308 0.077595 0.908823
C -1.609050 2.193866 -1.246829
C 3.734977 0.422835 -0.338391
C 0.654248 0.598036 -0.026777
C -1.368903 -0.002339 -2.486607
C -1.025529 -0.903654 0.775027
C -2.007881 2.881763 0.065390
C 2.965295 2.085218 1.411220
C 3.895953 -1.058140 -0.706639
C 1.152901 -0.945527 1.779591
C -0.146881 -1.449248 1.713817
C -2.011505 4.402417 -0.071907
C 4.680073 -1.234549 -2.004765
C -2.787631 -2.324187 -0.084717
C -4.213388 -2.628254 0.219272
H -2.680661 0.366823 -0.802056
H 3.533692 0.036469 1.783680
H -2.292217 2.510728 -2.058551
H -0.603059 2.530883 -1.560429
H 4.730703 0.900342 -0.262333
H 3.210289 0.956769 -1.152952
H 0.976955 1.389025 -0.704837
H -1.388697 -1.100776 -2.398508
H -0.381947 0.267453 -2.876813
H -2.114410 0.282926 -3.234257
H -3.008244 2.531508 0.386770
H -1.311753 2.578373 0.873461
H 3.980279 2.462227 1.575147
H 2.495791 2.720665 0.652242
H 2.404788 2.226145 2.342963
H 4.403867 -1.600100 0.114399
H 2.896392 -1.529476 -0.805534
H 1.849859 -1.355942 2.508127
H -0.480118 -2.244950 2.375924
H -2.294195 4.883005 0.871471
H -1.023573 4.785147 -0.351283
H -2.721230 4.737919 -0.836378
H 4.784420 -2.295144 -2.260816
H 4.180037 -0.743895 -2.847615
H 5.688709 -0.813590 -1.930148
H -4.336110 -2.999771 1.249373
H -4.607912 -3.390904 -0.469560
H -4.845170 -1.729571 0.136039


%chk=000221758-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221758

0 1
O -2.404400 -1.280136 0.886397
O -2.149597 -2.675590 -0.984822
C -1.588497 0.686164 -1.213732
C 3.070674 0.621313 0.926593
C -0.638952 0.144547 -0.141471
C 1.626525 0.111841 0.892312
C -1.698240 2.238124 -1.178149
C 3.844384 0.298374 -0.385479
C 0.706797 0.585003 -0.075481
C -1.159676 0.186533 -2.620197
C -1.038628 -0.817226 0.818540
C -2.278846 2.799319 0.139313
C 3.123561 2.141497 1.235296
C 4.002200 -1.211970 -0.671205
C 1.171377 -0.842356 1.836416
C -0.159522 -1.307428 1.801583
C -2.403089 4.338092 0.125770
C 4.796524 -1.491607 -1.965312
C -2.858501 -2.227177 -0.064147
C -4.298867 -2.581281 0.232031
H -2.601994 0.289672 -1.008562
H 3.590366 0.092364 1.752641
H -2.340836 2.556456 -2.025123
H -0.701200 2.689198 -1.362675
H 4.849665 0.764710 -0.322591
H 3.331419 0.782028 -1.242770
H 1.042998 1.327026 -0.810434
H -1.123250 -0.916103 -2.646362
H -0.158759 0.573202 -2.888979
H -1.875318 0.533757 -3.388962
H -3.275210 2.346197 0.319142
H -1.638036 2.484769 0.986129
H 4.171165 2.486448 1.318140
H 2.638024 2.727491 0.432466
H 2.605632 2.375963 2.182834
H 4.512736 -1.692875 0.188749
H 3.001363 -1.680308 -0.741013
H 1.860596 -1.225212 2.598256
H -0.523819 -2.043494 2.525279
H -2.823518 4.718314 1.074955
H -1.414460 4.813766 -0.019597
H -3.061679 4.678213 -0.696127
H 4.902935 -2.576956 -2.146408
H 4.287716 -1.052232 -2.844179
H 5.812398 -1.055581 -1.913167
H -4.384406 -2.995561 1.251420
H -4.660193 -3.316097 -0.501303
H -4.927359 -1.674491 0.195682


