%chk=000256565.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256565

0 1
S 1.679226 -2.784769 -1.575377
N -1.605118 1.150311 -0.394669
N 0.816843 -0.559505 -0.506787
C -0.893678 0.840053 -1.664034
C -0.759784 0.857835 0.813262
C -0.140986 -0.500599 -1.652042
C 0.711061 0.556570 0.471333
C -2.956902 0.654635 -0.264393
C 1.693382 -1.582921 -0.410875
C 2.670948 -1.679924 0.725202
C -3.590238 -0.140840 -1.236968
C -3.695409 1.082083 0.860219
C 3.663718 -0.549290 0.772901
C -4.932033 -0.493252 -1.089534
C -5.033181 0.718875 1.000201
C -5.666745 -0.072613 0.029114
C 4.353572 -0.167239 -0.388043
C 3.923648 0.106629 1.985461
C -7.101614 -0.463061 0.173329
C 5.285781 0.871212 -0.335643
C 4.860486 1.143416 2.030917
C 5.539650 1.530529 0.872070
H -0.186534 1.685019 -1.843577
H -1.604386 0.865488 -2.520443
H -1.181106 0.018304 1.411626
H -0.800095 1.770692 1.453011
H -0.850467 -1.360500 -1.571410
H 0.412555 -0.641141 -2.613950
H 1.209337 1.458698 0.041151
H 1.260475 0.316929 1.409046
H 2.126453 -1.794391 1.688630
H 3.247353 -2.640090 0.631018
H -3.048009 -0.490244 -2.112928
H -3.230614 1.716376 1.612005
H -5.410279 -1.107082 -1.851945
H -5.591185 1.058830 1.871588
H 4.167628 -0.688933 -1.328987
H 3.411358 -0.194993 2.896205
H -7.541535 -0.120740 1.118617
H -7.711332 -0.038901 -0.637471
H -7.225420 -1.554746 0.138106
H 5.820078 1.164637 -1.238765
H 5.063344 1.648139 2.974416
H 6.267953 2.338112 0.909813


%chk=000256565-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000256565

0 1
S 2.864427 -3.026303 -1.585810
N -1.623311 -0.346898 -0.243326
N 1.131915 -1.347792 -0.328788
C -0.901909 -0.503159 -1.517573
C -0.860673 -0.619812 0.983865
C 0.165574 -1.607577 -1.429034
C 0.648588 -0.434324 0.739185
C -2.975123 0.036962 -0.189651
C 2.374434 -1.930610 -0.347074
C 3.359800 -1.555568 0.763923
C -3.644423 0.569915 -1.334489
C -3.730598 -0.089547 1.014898
C 3.844905 -0.102844 0.703949
C -5.000670 0.942133 -1.267902
C -5.085888 0.299097 1.060904
C -5.756426 0.819497 -0.072978
C 4.291816 0.452107 -0.523321
C 3.898815 0.695455 1.873520
C -7.217568 1.233320 -0.016812
C 4.780684 1.775835 -0.576242
C 4.391407 2.020198 1.823764
C 4.832698 2.565716 0.596771
H -0.432174 0.449295 -1.849210
H -1.614469 -0.806119 -2.306223
H -1.050933 -1.644001 1.376655
H -1.162325 0.095599 1.773880
H -0.308618 -2.596503 -1.273380
H 0.735247 -1.676472 -2.373444
H 0.860161 0.617051 0.461856
H 1.186673 -0.641299 1.676420
H 2.927807 -1.766518 1.762917
H 4.218132 -2.237533 0.643436
H -3.101179 0.721432 -2.272739
H -3.274309 -0.517864 1.912991
H -5.480402 1.350221 -2.167015
H -5.636638 0.182252 2.002856
H 4.259650 -0.163162 -1.430644
H 3.563815 0.276994 2.831784
H -7.656541 1.020063 0.973508
H -7.342734 2.316190 -0.210420
H -7.822211 0.697162 -0.772866
H 5.126258 2.190288 -1.530226
H 4.430106 2.622755 2.738424
H 5.214405 3.591964 0.555060


