%chk=000185278.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185278

0 1
S -2.757414 -0.880024 0.899145
O -1.670453 -0.436034 -1.475220
N -0.195400 -1.107623 0.157053
C 0.983110 -1.101229 -0.771229
C 2.006790 -0.095879 -0.269037
C 1.524414 -2.520378 -0.953070
C 0.008227 -1.473620 1.575333
C 1.754332 1.268724 -0.490633
C 3.175814 -0.478925 0.399728
C -1.436947 -0.771258 -0.332247
C -4.197521 -0.309342 -0.064044
C 2.663748 2.233111 -0.052810
C 4.086556 0.490025 0.835175
C -4.683401 1.011286 0.515767
C 3.833504 1.845506 0.610525
C -5.930109 1.503552 -0.219072
H 0.604116 -0.746204 -1.779383
H 2.385806 -2.523627 -1.632646
H 0.758922 -3.175938 -1.390385
H 1.839383 -2.982540 -0.011401
H -0.344631 -0.669977 2.248857
H 1.080267 -1.623483 1.788055
H -0.522643 -2.409687 1.825490
H 0.841629 1.576312 -1.003365
H 3.389716 -1.530449 0.581964
H -4.970500 -1.098262 -0.010693
H -3.914391 -0.204412 -1.136304
H -4.906945 0.907107 1.597263
H -3.884322 1.779075 0.445687
H 2.461807 3.288729 -0.228377
H 4.995423 0.184388 1.350666
H 4.542831 2.597906 0.949575
H -6.759311 0.791917 -0.137205
H -6.276477 2.459074 0.191492
H -5.734231 1.659679 -1.286854


%chk=000185278-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185278

0 1
S -2.857216 -1.059582 1.204258
O -1.818908 -0.455889 -1.285256
N -0.247217 -1.107953 0.324690
C 0.873036 -1.054468 -0.674762
C 1.944750 -0.056154 -0.210732
C 1.385900 -2.474838 -0.987068
C 0.055089 -1.564326 1.692573
C 1.559635 1.292124 0.017810
C 3.300196 -0.415579 -0.012832
C -1.525171 -0.829554 -0.114199
C -4.320360 -0.444034 0.171803
C 2.502764 2.254134 0.434195
C 4.249613 0.547351 0.405416
C -4.494421 1.082226 0.230747
C 3.855387 1.884107 0.631299
C -5.710637 1.540591 -0.607064
H 0.400070 -0.650596 -1.589281
H 2.151673 -2.443337 -1.782454
H 0.549301 -3.099472 -1.343823
H 1.829730 -2.964148 -0.101123
H -0.554803 -1.011162 2.427035
H 1.116063 -1.355806 1.907875
H -0.134473 -2.646775 1.822042
H 0.512228 1.580692 -0.132427
H 3.628778 -1.445545 -0.188379
H -5.195031 -0.981577 0.577881
H -4.121557 -0.779072 -0.860335
H -4.615792 1.406007 1.282147
H -3.573339 1.557770 -0.153756
H 2.187707 3.290149 0.602240
H 5.294720 0.251986 0.552812
H 4.590344 2.629874 0.954259
H -6.649820 1.091111 -0.232446
H -5.822746 2.639321 -0.567762
H -5.593793 1.249923 -1.667583


