%chk=000238627.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238627

0 1
S 1.855011 2.528738 0.946161
O -4.491063 1.736533 -1.070837
O 5.457988 -2.624392 -1.285607
O 7.019301 -1.402369 -0.421158
N 5.853068 -1.626716 -0.702824
C -2.345002 1.252934 -0.204540
C 0.246833 1.976097 0.470539
C -3.759835 0.904531 -0.577876
C -4.216941 -0.491706 -0.311896
C -1.584243 2.026854 -1.091888
C -1.809268 0.851127 1.026585
C -0.274488 2.386265 -0.757469
C -0.503807 1.216174 1.369903
C 2.957769 1.263970 0.428650
C -3.331890 -1.578255 -0.366377
C -5.576381 -0.708228 -0.037396
C 2.545681 0.111772 -0.247470
C 4.307997 1.486799 0.739653
C 4.847041 -0.620814 -0.310335
C 3.495374 -0.839329 -0.620949
C 5.259142 0.540021 0.368449
C -3.803609 -2.872277 -0.133976
C -6.042443 -2.003193 0.203109
C -5.156644 -3.084456 0.155077
H -2.022954 2.356383 -2.037263
H -2.410986 0.260454 1.720039
H 0.320653 2.987586 -1.447977
H -0.085808 0.911626 2.331456
H -2.278581 -1.417389 -0.598213
H -6.263817 0.141606 -0.020538
H 1.494742 -0.055399 -0.489219
H 4.621072 2.390583 1.267596
H 3.200325 -1.751378 -1.152182
H 6.321043 0.686543 0.597653
H -3.118303 -3.717581 -0.180014
H -7.096675 -2.169708 0.421438
H -5.521003 -4.095307 0.339196


%chk=000238627-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000238627

0 1
S 1.896442 2.323834 1.442273
O -4.118220 1.402068 -1.665382
O 5.848297 -2.152286 -1.880558
O 7.436519 -0.810898 -0.935523
N 6.205421 -1.141114 -1.156736
C -2.235142 0.942479 -0.251703
C 0.293549 1.734497 0.742720
C -3.598945 0.619429 -0.808937
C -4.339877 -0.605509 -0.357729
C -1.349467 1.705915 -1.059892
C -1.844611 0.599321 1.069573
C -0.088909 2.098237 -0.571613
C -0.584017 0.997040 1.568421
C 3.128282 1.248584 0.612644
C -3.679143 -1.785604 0.081493
C -5.758507 -0.598989 -0.452891
C 2.782191 0.128765 -0.183864
C 4.494118 1.579756 0.825184
C 5.145163 -0.315702 -0.545972
C 3.792335 -0.656707 -0.768037
C 5.507864 0.796888 0.248095
C -4.427044 -2.931678 0.428654
C -6.503468 -1.737474 -0.089679
C -5.839069 -2.907536 0.353448
H -1.678219 1.997469 -2.062507
H -2.531651 0.049149 1.719958
H 0.590265 2.689097 -1.194179
H -0.284781 0.740287 2.589255
H -2.585205 -1.821579 0.115948
H -6.250544 0.307786 -0.819850
H 1.732322 -0.131584 -0.345468
H 4.760375 2.448006 1.437017
H 3.553064 -1.526204 -1.385938
H 6.565250 1.030794 0.396031
H -3.910906 -3.842675 0.750345
H -7.596641 -1.719784 -0.154681
H -6.417794 -3.795983 0.629581


