%chk=000292052.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292052

0 1
S -0.685532 -0.548315 -1.948752
O 5.381899 0.306249 0.457975
N -1.040577 -0.115849 0.605750
C -2.474950 -0.173919 0.348825
C -3.174653 0.970263 -0.093364
C -0.144185 -0.245321 -0.405571
C 1.302721 -0.136872 -0.150544
C -3.137400 -1.389033 0.581181
C -0.662995 0.096440 2.024283
C -4.562594 0.863290 -0.278379
C -2.473139 2.253506 -0.383692
C -4.517439 -1.467453 0.388480
C -5.227605 -0.340718 -0.038604
C 2.139562 -1.210139 -0.494283
C 1.861197 1.055481 0.353100
C 3.520443 -1.124023 -0.303545
C 3.231080 1.166294 0.542832
C 4.052310 0.065327 0.211735
C 6.336444 -0.728704 0.114305
H -2.574337 -2.268489 0.891553
H -0.700869 1.168332 2.283643
H 0.354246 -0.279342 2.232156
H -1.360420 -0.440353 2.691802
H -5.125027 1.729434 -0.624605
H -1.870445 2.152327 -1.306265
H -3.165213 3.089198 -0.546553
H -1.787096 2.547914 0.419482
H -5.036665 -2.408202 0.560999
H 1.707930 -2.121318 -0.918922
H 1.212485 1.901790 0.582681
H -6.304056 -0.404099 -0.192782
H 4.154772 -1.963123 -0.569122
H 3.686529 2.077141 0.924581
H 7.287374 -0.257379 0.396317
H 6.304449 -0.933422 -0.959939
H 6.151956 -1.627709 0.708844


%chk=000292052-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000292052

0 1
S -0.694204 -0.962260 -1.947267
O 5.403422 0.473774 0.497412
N -1.089355 -0.244031 0.650923
C -2.521552 -0.193157 0.379675
C -3.096831 0.977472 -0.189303
C -0.185924 -0.487596 -0.370825
C 1.267604 -0.282707 -0.089488
C -3.325130 -1.292814 0.755224
C -0.727955 -0.170962 2.089364
C -4.502259 0.997038 -0.371272
C -2.240093 2.149710 -0.620578
C -4.722274 -1.251880 0.564867
C -5.312850 -0.099347 -0.000982
C 2.221244 -1.212798 -0.574808
C 1.746542 0.888436 0.569158
C 3.603957 -1.013018 -0.390515
C 3.122097 1.115001 0.737950
C 4.058366 0.158980 0.268078
C 6.415760 -0.466868 0.007273
H -2.847352 -2.189120 1.166759
H -0.858101 0.854575 2.483923
H 0.315177 -0.483490 2.237873
H -1.390737 -0.843183 2.661861
H -4.963796 1.888428 -0.812685
H -1.624824 1.870199 -1.497333
H -2.863706 3.016340 -0.897783
H -1.541654 2.467582 0.175725
H -5.339655 -2.112161 0.844885
H 1.859276 -2.093189 -1.115467
H 1.035817 1.646958 0.915747
H -6.396704 -0.054874 -0.155071
H 4.308856 -1.758891 -0.769118
H 3.496446 2.023875 1.218427
H 7.380750 -0.018592 0.284917
H 6.358719 -0.580635 -1.092371
H 6.311123 -1.457592 0.490428


