%chk=000223590.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223590

0 1
O -3.597901 0.417930 -0.720332
O -1.549631 -2.089603 0.294327
O -4.220691 -0.927850 1.008156
O 5.190685 1.219972 -0.314114
O 5.223579 -0.901643 0.106682
N -1.037996 0.159634 0.002566
N 4.640926 0.151651 -0.094382
C 0.385884 0.105703 -0.024795
C 1.071935 1.318398 -0.276580
C 1.099850 -1.087380 0.200346
C 3.169177 0.135411 -0.070689
C 2.460271 1.329046 -0.298214
C 2.490051 -1.070128 0.177567
C -1.894050 -0.941316 0.179659
C -4.956625 0.954429 -0.893214
C -3.387507 -0.519707 0.251670
C -5.269010 1.935779 0.212441
H 0.524663 2.243176 -0.453938
H 0.569459 -2.029277 0.390446
H 3.012679 2.257103 -0.490958
H 3.063467 -1.989814 0.351277
H -1.468096 1.073854 -0.203758
H -4.857987 1.424338 -1.889852
H -5.659670 0.103064 -0.926100
H -6.229143 2.440303 0.037124
H -5.344696 1.433576 1.189752
H -4.501724 2.714553 0.303514


%chk=000223590-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000223590

0 1
O -3.482977 0.720660 -0.562313
O -1.596572 -2.076977 0.689020
O -4.348928 -1.293231 0.264646
O 5.256204 1.269273 -0.459619
O 5.320692 -0.839740 0.412484
N -1.010277 0.044295 -0.177564
N 4.681817 0.190524 -0.035404
C 0.401415 0.027253 -0.120626
C 1.086009 1.191198 -0.576864
C 1.142645 -1.087865 0.365813
C 3.205448 0.134476 -0.065179
C 2.486265 1.250257 -0.551319
C 2.546445 -1.028318 0.391029
C -1.899952 -0.955036 0.208114
C -4.871992 1.243635 -0.807712
C -3.382642 -0.563091 -0.009005
C -5.438635 1.885665 0.459407
H 0.514274 2.048541 -0.951367
H 0.613556 -1.976249 0.713827
H 3.031339 2.132351 -0.896169
H 3.139959 -1.869300 0.758979
H -1.461111 0.890309 -0.546828
H -4.730808 1.970178 -1.623044
H -5.493663 0.398471 -1.150639
H -6.426043 2.328768 0.233643
H -5.575668 1.135991 1.256168
H -4.778899 2.689163 0.829123


