%chk=000276157.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276157

0 1
O 3.282096 1.222450 -0.803598
O 3.578184 -1.999001 -1.179436
O 3.484528 -0.706845 2.039050
O 6.380209 1.628016 0.944618
N 1.054210 0.543240 -0.766511
N -0.717446 1.892928 -0.197322
N -0.184670 -1.608678 -1.075446
N -2.579585 -1.363306 -0.674369
N -3.598183 0.731653 -0.029973
N -5.884274 0.960664 0.349393
C 2.882859 -1.114164 -0.305765
C 2.428299 0.123982 -1.131824
C 3.929633 -0.572431 0.699971
C 4.148838 0.911582 0.328760
C 5.567284 1.239764 -0.162400
C -0.086401 -0.268408 -0.788189
C 0.599828 1.858847 -0.405678
C -1.190583 0.588489 -0.425477
C -2.484264 -0.016875 -0.375378
C -1.458363 -2.078245 -1.001047
C -4.824323 0.177509 -0.006636
C -7.250821 0.400222 0.381052
C -5.753770 2.386842 0.712290
H 2.051107 -1.650400 0.203438
H 2.515950 -0.012503 -2.237679
H 4.859125 -1.190151 0.682012
H 3.843991 1.599965 1.148542
H 5.556347 2.144864 -0.806678
H 6.035805 0.408082 -0.715890
H 2.941763 -2.647190 -1.569262
H 2.636521 -0.231586 2.193388
H 1.298118 2.684041 -0.332662
H 6.532931 0.868324 1.546417
H -1.609974 -3.146962 -1.224888
H -5.052025 -0.880262 -0.258669
H -7.266152 -0.671868 0.121834
H -7.904669 0.929308 -0.336740
H -7.690787 0.507845 1.389707
H -6.355915 3.019636 0.040487
H -4.694201 2.721009 0.625047
H -6.068121 2.556115 1.755011


%chk=000276157-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000276157

0 1
O 3.276995 1.366287 -0.768069
O 2.522188 -2.218734 -0.453513
O 5.018719 -1.204513 1.287081
O 6.633126 1.280251 0.943266
N 0.972038 0.683506 -0.689663
N -0.875306 2.039019 -0.505392
N -0.123819 -1.533591 -0.504296
N -2.544236 -1.351695 -0.229146
N -3.697603 0.775486 -0.180409
N -6.015280 0.847154 0.188230
C 2.798484 -0.899675 0.038309
C 2.357568 0.235819 -0.944278
C 4.300234 -0.594731 0.168809
C 4.316783 0.955680 0.228818
C 5.673901 1.572298 -0.127049
C -0.123288 -0.166345 -0.542438
C 0.458706 1.994969 -0.669532
C -1.266386 0.686277 -0.429153
C -2.529905 0.039346 -0.267840
C -1.384678 -2.047168 -0.342242
C -4.828051 0.173757 0.168718
C -7.262141 0.184487 0.594954
C -6.093108 2.266023 -0.204037
H 2.304137 -0.706850 1.022629
H 2.432305 -0.131109 -1.986851
H 4.825071 -0.955430 -0.733383
H 4.013774 1.300139 1.240458
H 5.606795 2.670709 -0.182771
H 6.018057 1.184491 -1.109220
H 1.500918 -2.271410 -0.519159
H 4.428506 -1.266976 2.080160
H 1.115536 2.854656 -0.766915
H 6.554627 0.316158 1.183943
H -1.458428 -3.138098 -0.303271
H -4.877711 -0.886835 0.466189
H -7.062746 -0.866989 0.858549
H -8.001598 0.207200 -0.228005
H -7.704468 0.691864 1.473351
H -6.710925 2.381531 -1.114581
H -5.070022 2.618792 -0.403801
H -6.545671 2.860751 0.611050


