%chk=000232262.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232262

0 1
S -3.544016 1.305792 -1.311619
O 3.894973 1.095069 1.269511
N 1.734249 0.336884 -0.467764
N -1.038171 1.163961 -0.342650
C 0.761230 -0.058274 -1.536091
C 1.028977 0.481530 0.850893
C -0.323671 1.031281 -1.654402
C -0.064489 1.558944 0.731138
C 2.925923 -0.464393 -0.381465
C -2.166423 2.118170 -0.419895
C 4.009226 -0.004545 0.417758
C 3.125793 -1.646313 -1.117475
C 5.222930 -0.693426 0.480330
C 4.344074 -2.330881 -1.061792
C 5.389535 -1.865513 -0.262409
C -4.225280 0.144673 -0.174899
C -5.614339 0.157264 -0.017711
C -3.426300 -0.788985 0.486109
C 3.900526 2.376907 0.584549
C -6.211803 -0.792220 0.817493
C -4.033141 -1.727206 1.328159
C -5.422467 -1.731058 1.491470
H 0.280541 -1.041525 -1.334735
H 1.304077 -0.135235 -2.503292
H 1.775020 0.791280 1.622530
H 0.581620 -0.479078 1.187101
H 0.134973 1.985481 -1.993043
H -1.060269 0.721753 -2.430008
H -0.612220 1.625743 1.696037
H 0.403285 2.549653 0.543807
H -1.964312 3.052875 -0.986524
H -2.503885 2.403271 0.598864
H 2.328182 -2.053087 -1.735691
H 6.020618 -0.306306 1.112741
H 4.471308 -3.241995 -1.645037
H 6.331352 -2.407812 -0.217340
H -6.229489 0.893786 -0.534921
H -2.340325 -0.787484 0.350443
H 4.859358 2.515838 0.079047
H 3.780100 3.081431 1.413539
H 3.065450 2.438167 -0.121750
H -7.292650 -0.797612 0.945333
H -3.421114 -2.458599 1.852731
H -5.891155 -2.465907 2.143527


%chk=000232262-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000232262

0 1
S -3.592673 1.381537 -1.369138
O 3.930750 1.113031 1.278073
N 1.749286 0.202113 -0.422186
N -0.970463 1.158426 -0.310570
C 0.799545 -0.098942 -1.515491
C 1.054672 0.377095 0.883445
C -0.272519 0.999146 -1.605413
C -0.016940 1.473238 0.784736
C 3.002092 -0.476911 -0.408310
C -2.120267 2.059358 -0.365411
C 4.073098 -0.025099 0.434058
C 3.261863 -1.605034 -1.238479
C 5.300667 -0.712000 0.482316
C 4.506193 -2.271605 -1.210317
C 5.528592 -1.841978 -0.335983
C -4.344695 0.188049 -0.182020
C -5.756828 0.075613 -0.177653
C -3.560128 -0.624271 0.672665
C 3.879012 2.397697 0.545627
C -6.383333 -0.853784 0.683370
C -4.199385 -1.533103 1.546989
C -5.608622 -1.656489 1.553491
H 0.294235 -1.081491 -1.361230
H 1.349996 -0.138784 -2.472114
H 1.799065 0.648253 1.648511
H 0.565324 -0.578698 1.181789
H 0.211229 1.957337 -1.922889
H -1.021790 0.719769 -2.368577
H -0.573830 1.525363 1.738990
H 0.484494 2.459752 0.621655
H -1.913228 3.028673 -0.874897
H -2.484443 2.257173 0.656204
H 2.471215 -1.986336 -1.891619
H 6.072887 -0.329249 1.158079
H 4.665414 -3.139935 -1.859476
H 6.488945 -2.366365 -0.296945
H -6.358110 0.715525 -0.832676
H -2.468199 -0.545273 0.632661
H 4.833062 2.568561 0.011123
H 3.737027 3.172836 1.314829
H 3.038961 2.405683 -0.173755
H -7.475871 -0.939158 0.681351
H -3.591097 -2.157191 2.211988
H -6.097403 -2.370233 2.225796


