%chk=000218916.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218916

0 1
S -7.695676 -0.181318 1.680246
O 1.139912 1.125517 -0.252557
N -6.121719 0.154291 -0.470054
N 2.857026 -0.436083 0.068550
C -4.833828 -0.566206 -0.199413
C -3.672074 0.434399 -0.323094
C -7.221191 -0.771601 -0.885503
C -2.321471 -0.270358 -0.149864
C -6.599189 0.935472 0.681462
C -7.923386 -1.386625 0.331363
C -1.162404 0.724617 -0.273021
C 0.177025 0.016102 -0.104083
C 2.461533 0.824130 -0.154126
C 5.173649 0.394439 0.016726
C 4.228923 -0.663825 0.156805
C 3.340558 1.956423 -0.308861
C 4.684148 1.722457 -0.220737
C 6.563765 0.094338 0.117601
C 4.686377 -1.999422 0.394495
C 6.982435 -1.194595 0.346111
C 6.033234 -2.248446 0.485360
H -4.817340 -1.062999 0.794913
H -4.711441 -1.370846 -0.956797
H -3.779793 1.242276 0.426222
H -3.722211 0.938817 -1.309646
H -7.941515 -0.166816 -1.484627
H -6.829690 -1.553346 -1.567891
H -2.213000 -1.071150 -0.908036
H -2.282377 -0.775990 0.835481
H -7.205158 1.792178 0.320265
H -5.786337 1.322066 1.323030
H -9.000184 -1.548098 0.156535
H -7.484610 -2.353910 0.628773
H -1.191445 1.240774 -1.254539
H -1.256051 1.531980 0.481714
H 0.321676 -0.432132 0.892982
H 0.389003 -0.729366 -0.888468
H 2.909784 2.937692 -0.486832
H 5.404116 2.535314 -0.328514
H 7.283774 0.904965 0.010199
H 3.942970 -2.790113 0.497953
H 8.041723 -1.431349 0.424365
H 6.398858 -3.259552 0.666112


%chk=000218916-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000218916

0 1
S -7.521533 -0.646600 1.924675
O 1.205566 1.293770 -0.403049
N -6.213825 0.169349 -0.386691
N 2.853119 -0.336399 0.057118
C -4.873521 -0.481230 -0.295240
C -3.723082 0.541598 -0.377993
C -7.304753 -0.723629 -0.842676
C -2.335067 -0.125569 -0.252670
C -6.666470 0.794033 0.831388
C -7.730491 -1.664388 0.338498
C -1.179214 0.893239 -0.383968
C 0.186545 0.227182 -0.211681
C 2.535480 0.925859 -0.252833
C 5.244562 0.339814 0.020878
C 4.201854 -0.649195 0.199784
C 3.490792 1.983935 -0.452978
C 4.838246 1.679173 -0.314340
C 6.611631 -0.045048 0.182120
C 4.566499 -1.989870 0.534381
C 6.943873 -1.363812 0.510517
C 5.913365 -2.339094 0.686986
H -4.784316 -1.077968 0.643149
H -4.788088 -1.186208 -1.143653
H -3.834198 1.300504 0.422458
H -3.801739 1.085082 -1.339275
H -8.169332 -0.098521 -1.132496
H -6.981010 -1.300765 -1.725585
H -2.228571 -0.907727 -1.033222
H -2.263158 -0.647316 0.724390
H -7.464903 1.526691 0.645701
H -5.850288 1.226560 1.425250
H -8.782776 -1.976363 0.245854
H -7.081972 -2.553365 0.404079
H -1.221392 1.384320 -1.375172
H -1.291514 1.691144 0.375322
H 0.315684 -0.215414 0.793650
H 0.362676 -0.570699 -0.957814
H 3.131846 2.984505 -0.705220
H 5.600578 2.453486 -0.458073
H 7.397194 0.708342 0.045377
H 3.763455 -2.721813 0.665513
H 7.992758 -1.654216 0.633732
H 6.183886 -3.369278 0.944409


