%chk=000206647.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206647

0 1
O -1.888921 -1.472690 -2.246779
O -4.738967 0.440132 0.848693
N -2.524912 1.048811 0.991216
N 0.380182 0.145519 -0.898414
N -3.315650 -0.514991 -0.709971
N -0.058559 1.508393 0.893529
N 5.013896 -0.862032 -1.330445
C -0.997793 0.051993 -0.635847
C -1.242191 0.906849 0.473517
C 0.908736 1.025634 0.042081
C -2.019510 -0.720491 -1.303567
C 2.343559 1.419603 0.100008
C -3.613697 0.328411 0.401584
C -2.772706 1.945340 2.146149
C 3.272424 0.252091 -0.057648
C -4.478358 -1.228577 -1.308469
C 3.299529 -0.779041 0.894794
C 4.151227 0.171091 -1.155944
C 4.183001 -1.844920 0.723479
C 5.025376 -1.852438 -0.402740
H 0.855861 -0.368473 -1.622025
H 2.541493 1.931386 1.078236
H 2.540485 2.208335 -0.664280
H -3.846297 1.929492 2.416734
H -2.481750 2.981086 1.895338
H -2.178604 1.618167 3.017986
H -4.122565 -2.077750 -1.922044
H -5.057656 -0.545972 -1.953220
H -5.146469 -1.610979 -0.516170
H 2.633723 -0.744845 1.759211
H 4.180161 0.950954 -1.926421
H 4.222778 -2.656989 1.447123
H 5.735575 -2.669501 -0.579394


%chk=000206647-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206647

0 1
O -1.870737 -1.609493 -2.188518
O -4.837583 0.548715 0.787882
N -2.563037 1.107184 0.943590
N 0.347566 0.071382 -0.803349
N -3.346440 -0.507559 -0.682296
N -0.113618 1.511746 0.894573
N 5.158899 -0.737810 -1.313848
C -1.033093 0.003859 -0.593834
C -1.283480 0.902650 0.452682
C 0.864781 0.984854 0.103981
C -2.048637 -0.779785 -1.245103
C 2.315202 1.382198 0.161080
C -3.652298 0.396287 0.378848
C -2.803363 2.059478 2.044856
C 3.292403 0.228690 -0.033914
C -4.506959 -1.233574 -1.248134
C 3.307184 -0.893592 0.834919
C 4.240015 0.247805 -1.088660
C 4.248845 -1.922011 0.621351
C 5.153184 -1.803827 -0.461371
H 0.865558 -0.477499 -1.490689
H 2.467136 1.866278 1.142591
H 2.513381 2.162142 -0.601288
H -3.881047 2.050014 2.262688
H -2.484039 3.072119 1.746672
H -2.231418 1.757550 2.938170
H -4.127408 -1.883412 -2.050199
H -5.243921 -0.516996 -1.645511
H -4.996967 -1.833820 -0.464208
H 2.594044 -0.955443 1.665624
H 4.272528 1.094476 -1.787085
H 4.287425 -2.798083 1.276203
H 5.899294 -2.580923 -0.661403


