%chk=000179894.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179894

0 1
O 0.862364 -1.196694 -0.315106
O -4.400560 1.976984 -0.345147
N 3.746678 -1.768587 -0.659617
N -1.551947 2.975083 -0.251704
N 1.400665 1.048174 -0.178620
N -3.738149 0.270082 1.065538
N -1.053837 0.819103 0.178176
N -0.205686 2.895288 -0.389599
N 6.712760 -0.013865 0.474420
N -2.164801 -2.048054 -0.736535
N -3.276430 -3.348273 0.979013
C 3.167089 -0.595998 -0.178807
C 4.198219 0.209378 0.360408
C 5.115811 -1.723588 -0.459158
C 5.413976 -0.492427 0.181277
C -4.896434 -0.629037 0.838148
C -2.074977 1.731789 0.088878
C 1.718292 -0.335802 -0.224899
C 0.090033 1.553043 -0.129753
C -4.574250 -1.693207 -0.226662
C 3.044304 -2.874784 -1.315503
C -3.519589 1.353819 0.222382
C -2.280519 4.230962 -0.459306
C -3.273243 -2.415763 0.078645
H 4.079418 1.165008 0.826439
H 5.790792 -2.498408 -0.766986
H -5.783751 -0.029623 0.528550
H -5.140882 -1.119663 1.810650
H -5.401468 -2.439230 -0.254046
H -4.554840 -1.243105 -1.239479
H 2.145024 1.753268 -0.237856
H -2.925490 -0.188437 1.500079
H 1.962190 -2.874754 -1.049402
H 3.118002 -2.793341 -2.415936
H 3.462368 -3.848949 -1.007847
H -2.212256 4.878233 0.435740
H -1.865514 4.792875 -1.318652
H -3.353915 4.012085 -0.663302
H 6.732536 0.676255 1.216960
H 7.386255 -0.747365 0.662732
H -2.200482 -1.139848 -1.184278
H -1.231232 -2.198487 -0.354297
H -2.416223 -3.843139 1.192263


%chk=000179894-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179894

0 1
O 0.783061 -1.281989 -0.283029
O -4.466254 2.273580 -0.121972
N 3.723290 -1.789385 -0.580283
N -1.509202 3.064350 -0.172260
N 1.318066 1.014472 -0.270334
N -3.677787 0.271092 0.854301
N -1.113939 0.876597 0.122787
N -0.128468 2.919819 -0.356422
N 6.652560 0.131975 0.399860
N -2.123155 -2.209740 0.047616
N -3.841517 -3.855051 0.529384
C 3.114119 -0.578784 -0.227260
C 4.140781 0.312281 0.189884
C 5.101476 -1.666894 -0.415130
C 5.392241 -0.371149 0.075016
C -4.852137 -0.589921 0.645507
C -2.076474 1.846969 0.116271
C 1.659918 -0.359015 -0.261307
C 0.044797 1.566762 -0.164500
C -4.520700 -1.706587 -0.390739
C 3.086070 -2.972925 -1.186000
C -3.527080 1.514160 0.283525
C -2.134492 4.385914 -0.288718
C -3.438542 -2.676792 0.087558
H 3.994391 1.305243 0.616142
H 5.771199 -2.491249 -0.653395
H -5.676837 0.044510 0.279354
H -5.157431 -1.050412 1.601802
H -5.427498 -2.308703 -0.560589
H -4.228717 -1.230159 -1.346106
H 2.068319 1.689004 -0.434660
H -2.807965 -0.205865 1.126256
H 2.010454 -2.950187 -0.963454
H 3.234650 -2.979881 -2.281559
H 3.531951 -3.886489 -0.757138
H -1.818287 5.029060 0.549470
H -1.824400 4.851255 -1.237555
H -3.225783 4.244084 -0.276364
H 6.755606 1.078037 0.749640
H 7.477680 -0.455608 0.352605
H -1.828611 -1.304865 -0.334258
H -1.351602 -2.802962 0.352713
H -3.053449 -4.453551 0.861141


