%chk=000185242.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185242

0 1
O -0.281149 1.725530 -0.277838
O -1.691652 3.021886 0.912415
O 3.692310 -1.241024 0.149669
N 0.860756 3.798118 -2.628714
C -2.399190 0.745234 0.192588
C -4.762131 -0.088978 0.392666
C -2.837093 -1.562742 1.090544
C -3.220411 -1.060557 -1.351607
C -3.856396 1.156512 0.504859
C -1.922897 -0.322742 1.206840
C -2.311786 0.183252 -1.243815
C -4.294279 -1.159259 1.402461
C -4.678594 -0.660099 -1.039446
C -2.750729 -2.130800 -0.342348
C -1.501263 1.975155 0.346581
C 0.744307 2.759371 -0.223424
C 2.041309 2.073869 0.155957
C 0.813731 3.340970 -1.570718
C 2.183580 0.694950 -0.029030
C 3.086739 2.839664 0.687316
C 3.394895 0.103723 0.343574
C 4.293820 2.219822 1.036970
C 4.462849 0.845518 0.875969
C 2.650540 -2.176153 0.105349
C 1.585555 -2.164961 1.012506
C 2.823312 -3.186006 -0.851146
C 0.659458 -3.209809 0.947694
C 1.885947 -4.219501 -0.888744
C 0.804854 -4.230587 0.002092
H -5.812652 0.201996 0.617781
H -2.501500 -2.334009 1.819246
H -3.158564 -1.470202 -2.384667
H -4.195308 1.944193 -0.192229
H -3.925733 1.599255 1.515922
H -1.951003 0.077635 2.235863
H -0.871404 -0.600147 1.002236
H -1.264591 -0.077550 -1.490571
H -2.616291 0.948221 -1.980095
H -4.373839 -0.773453 2.433770
H -4.953693 -2.043394 1.353214
H -5.345022 -1.534252 -1.141363
H -5.036334 0.085332 -1.771065
H -1.715313 -2.443110 -0.569662
H -3.373377 -3.037780 -0.432013
H 0.438278 3.540266 0.530027
H 1.369020 0.110511 -0.461060
H 2.973099 3.913140 0.825719
H 5.109408 2.819499 1.444081
H 5.391262 0.344676 1.144026
H 1.493182 -1.375121 1.754173
H 3.671212 -3.153262 -1.532302
H -0.178615 -3.229335 1.644749
H 1.996283 -5.020604 -1.620030
H 0.078802 -5.039958 -0.038970


%chk=000185242-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000185242

0 1
O -0.485445 1.084449 -0.899710
O -1.276380 3.006503 0.159591
O 4.308423 -1.222224 0.850489
N 1.563248 1.140575 -3.612853
C -2.709801 0.974662 0.054798
C -5.048819 0.971908 1.043584
C -3.606499 -1.104693 1.229273
C -4.554097 -0.413385 -1.019560
C -3.787286 1.832994 0.775716
C -2.337914 -0.254759 0.956866
C -3.289604 0.442448 -1.298778
C -4.674827 -0.234917 1.946560
C -5.623785 0.455393 -0.302900
C -4.180060 -1.621089 -0.118255
C -1.466738 1.820903 -0.195523
C 0.820060 1.810980 -1.143811
C 1.824250 1.441747 -0.061466
C 1.231139 1.432502 -2.505803
C 2.581647 0.250954 -0.158927
C 1.959229 2.289167 1.065370
C 3.463651 -0.091115 0.889098
C 2.860237 1.938673 2.095706
C 3.615016 0.749751 2.015564
C 3.928902 -2.403340 0.155973
C 2.608594 -2.909891 0.178059
C 4.973642 -3.110852 -0.476513
C 2.338593 -4.139794 -0.462456
C 4.688429 -4.340851 -1.108760
C 3.371499 -4.858102 -1.109075
H -5.805950 1.597307 1.555574
H -3.329395 -1.964274 1.871252
H -4.954367 -0.778953 -1.985529
H -4.044060 2.711042 0.153063
H -3.379088 2.226483 1.726158
H -1.909218 0.105282 1.913306
H -1.564704 -0.861640 0.450151
H -2.522318 -0.156874 -1.822426
H -3.549277 1.297469 -1.954647
H -4.281869 0.125153 2.918594
H -5.576376 -0.842044 2.162294
H -6.537876 -0.144352 -0.121022
H -5.915092 1.310065 -0.945987
H -3.432923 -2.260042 -0.630106
H -5.075572 -2.246886 0.066796
H 0.597400 2.895418 -1.104761
H 2.492323 -0.390507 -1.041707
H 1.360110 3.203263 1.135109
H 2.975433 2.592607 2.966233
H 4.319956 0.460923 2.800596
H 1.810515 -2.364751 0.692580
H 5.984033 -2.691448 -0.463588
H 1.317748 -4.537530 -0.449318
H 5.495604 -4.892018 -1.603357
H 3.153356 -5.809386 -1.605516


