%chk=000262548.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000262548

0 1
O 4.030937 1.493802 -0.275918
N 1.406430 0.687214 0.035255
N 2.403517 -0.225013 -0.251757
N 4.688473 -0.660968 -0.731899
C -2.606115 -0.101573 0.517253
C -1.753941 -1.333679 0.077938
C -0.826348 1.472125 0.352313
C -1.744025 0.820576 1.410630
C -2.961858 0.817824 -0.682620
C -1.800055 1.831340 -0.798953
C -0.466793 -0.867673 -0.669191
C 0.147995 0.390983 -0.104668
C -2.580021 -2.230992 -0.862678
C -1.355392 -2.159018 1.315567
C 3.718848 0.331058 -0.396033
H -3.518140 -0.448103 1.038431
H -0.289574 2.364877 0.736446
H -1.183180 0.281868 2.189527
H -2.358280 1.574311 1.927679
H -3.916168 1.336046 -0.495532
H -3.097286 0.244900 -1.613603
H -1.307175 1.786776 -1.781931
H -2.162215 2.865917 -0.682302
H -0.717651 -0.665840 -1.733113
H 0.255748 -1.703891 -0.686502
H -1.998572 -3.086082 -1.220584
H -3.463935 -2.631078 -0.354162
H -2.934828 -1.680202 -1.741853
H -2.230673 -2.443616 1.908317
H -0.838243 -3.082156 1.037321
H -0.683256 -1.593620 1.973644
H 2.178656 -1.088203 -0.763990
H 5.652154 -0.345262 -0.668380
H 4.570068 -1.610848 -0.413853


%chk=000262548-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000262548

0 1
O 4.178701 1.198385 0.437365
N 1.410208 0.777084 0.052582
N 2.382308 -0.125730 -0.363503
N 4.597212 -0.794763 -0.699702
C -2.615000 -0.112403 0.485185
C -1.700613 -1.324990 0.083274
C -0.868622 1.521796 0.342903
C -1.836266 0.886018 1.383048
C -2.995149 0.800095 -0.729817
C -1.860218 1.882135 -0.813317
C -0.456150 -0.794362 -0.715741
C 0.138617 0.473371 -0.105249
C -2.485816 -2.329299 -0.799230
C -1.207620 -2.083702 1.347294
C 3.747689 0.180222 -0.160148
H -3.516284 -0.514478 0.986962
H -0.317151 2.396108 0.724378
H -1.317842 0.427187 2.240322
H -2.520918 1.661557 1.778575
H -3.973480 1.279024 -0.541714
H -3.098409 0.232405 -1.671455
H -1.358600 1.901321 -1.797417
H -2.268262 2.893852 -0.637251
H -0.771607 -0.565932 -1.755415
H 0.277436 -1.623338 -0.791123
H -1.827962 -3.152807 -1.137423
H -3.319425 -2.779417 -0.227751
H -2.913153 -1.851246 -1.699034
H -2.051518 -2.312528 2.024914
H -0.738257 -3.043974 1.060103
H -0.459383 -1.507535 1.919138
H 2.126090 -1.018481 -0.803888
H 5.594473 -0.644292 -0.572756
H 4.284072 -1.589482 -1.253308


