%chk=000259080.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259080

0 1
S -2.332353 2.294210 -0.199064
N -1.295132 -0.155661 -0.021427
C -0.598924 -1.193634 -0.851153
C -1.372000 -2.533245 -0.911175
C 0.835072 -1.388725 -0.308285
C -1.765578 -3.045082 0.479502
C -1.708708 -0.662618 1.318680
C -2.519028 -1.969597 1.271704
C 1.688805 -0.129931 -0.508849
C -2.379585 0.536921 -0.739960
C 3.068407 -0.272818 0.144303
C 3.922833 0.985081 -0.067789
C 5.298336 0.850730 0.581936
C -0.585860 2.774694 -0.440379
C -0.370964 4.049905 0.344072
H -0.519602 -0.793679 -1.897545
H -2.282569 -2.396708 -1.525101
H -0.766313 -3.294030 -1.436032
H 1.304862 -2.250476 -0.817861
H 0.801128 -1.654645 0.766035
H -2.390841 -3.952399 0.382985
H -0.860118 -3.356052 1.035768
H -0.773717 -0.814457 1.904325
H -2.279681 0.132413 1.845623
H -2.721182 -2.322393 2.299388
H -3.509524 -1.786965 0.814634
H 1.151459 0.751843 -0.081338
H 1.799907 0.083096 -1.588507
H -2.244008 0.494010 -1.838918
H -3.406471 0.183934 -0.510787
H 3.593199 -1.156222 -0.266772
H 2.954558 -0.468681 1.227920
H 3.398842 1.868765 0.346441
H 4.039285 1.182820 -1.151246
H 5.859499 0.005425 0.167920
H 5.900263 1.752674 0.425078
H 5.219680 0.692901 1.663599
H -0.390157 2.914099 -1.517600
H 0.081580 1.951276 -0.085173
H -1.029509 4.862400 0.007103
H -0.555386 3.908594 1.418561
H 0.662093 4.407024 0.237983


%chk=000259080-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259080

0 1
S -2.618014 2.324955 -0.167399
N -1.311285 -0.190196 -0.062848
C -0.569588 -1.228829 -0.845884
C -1.366998 -2.570658 -0.883358
C 0.877941 -1.426381 -0.321872
C -1.756925 -3.055143 0.537453
C -1.679457 -0.627951 1.308049
C -2.505121 -1.942854 1.313812
C 1.738724 -0.146724 -0.357437
C -2.365537 0.516701 -0.772716
C 3.189351 -0.378867 0.121205
C 4.049618 0.905557 0.098792
C 5.494920 0.672829 0.589892
C -0.913894 3.020049 -0.621176
C -0.580020 4.232277 0.260880
H -0.488227 -0.840994 -1.882585
H -2.291485 -2.418113 -1.477544
H -0.772563 -3.347104 -1.404557
H 1.354191 -2.209791 -0.947132
H 0.864775 -1.824963 0.711620
H -2.384510 -3.964098 0.465651
H -0.846052 -3.345445 1.098757
H -0.752940 -0.774107 1.896885
H -2.236006 0.200725 1.783001
H -2.699056 -2.257696 2.357697
H -3.493701 -1.763884 0.843647
H 1.256441 0.624900 0.273754
H 1.753379 0.258796 -1.391690
H -2.123089 0.559255 -1.848042
H -3.388049 0.097647 -0.655275
H 3.672037 -1.152748 -0.512534
H 3.174606 -0.789116 1.153156
H 3.563053 1.678709 0.728044
H 4.068979 1.312320 -0.933006
H 6.012594 -0.073704 -0.041942
H 6.087936 1.605676 0.565587
H 5.503149 0.293885 1.629537
H -0.923664 3.289626 -1.691956
H -0.203455 2.192073 -0.455864
H -1.324881 5.039817 0.140977
H -0.555540 3.945790 1.327027
H 0.410959 4.642578 -0.012005


