%chk=000225276.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225276

0 1
S 0.018293 1.517301 -0.553427
O 0.195296 1.092828 -1.934801
O 0.462252 2.838730 -0.150777
C 0.840310 0.336581 0.522003
C 0.287056 -1.051907 0.348072
C 2.333419 0.351430 0.307696
C -1.659132 1.361404 -0.122138
C -2.455029 0.400505 -0.743497
C -0.204982 -1.740051 1.469142
C 3.176984 0.401842 1.430129
C 0.264942 -1.676481 -0.909318
C 2.895357 0.297983 -0.976748
C -2.205683 2.227707 0.829548
C -3.812518 0.278042 -0.396890
C -3.553637 2.111703 1.177445
C -0.714962 -3.034029 1.330475
C 4.564524 0.403544 1.265891
C -0.244126 -2.969860 -1.040644
C 4.283625 0.301068 -1.133244
C -4.354094 1.138538 0.569899
C -0.736254 -3.652155 0.076979
C 5.121875 0.353050 -0.015304
C -4.656231 -0.757564 -1.064021
H 0.647257 0.670124 1.580583
H -2.030449 -0.258216 -1.508694
H -0.186053 -1.273450 2.451903
H 2.755420 0.440536 2.432069
H 0.644733 -1.148546 -1.792292
H 2.255042 0.264142 -1.866244
H -1.586115 3.005136 1.288867
H -3.984549 2.784076 1.918139
H -1.093127 -3.562197 2.204504
H 5.212328 0.445990 2.139932
H -0.252786 -3.448971 -2.019143
H 4.711871 0.265899 -2.134410
H -5.404899 1.054538 0.846846
H -1.129008 -4.661211 -0.028330
H 6.202233 0.357180 -0.141988
H -5.679272 -0.794955 -0.668150
H -4.737352 -0.567954 -2.145198
H -4.227958 -1.763732 -0.943465


%chk=000225276-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225276

0 1
S 0.017187 1.420902 -0.570334
O 0.062115 0.904014 -2.130882
O 0.568667 2.905377 -0.152160
C 1.076061 -0.013963 0.611476
C 0.437342 -1.334703 0.346455
C 2.521610 0.250142 0.314098
C -1.794233 1.326904 -0.016873
C -2.646553 0.446566 -0.696210
C -0.654894 -1.736687 1.169193
C 3.383982 0.539621 1.405439
C 0.867813 -2.212339 -0.687047
C 3.060735 0.233166 -1.002780
C -2.206932 2.180551 1.019981
C -4.013133 0.387650 -0.312022
C -3.566805 2.118139 1.399590
C -1.295307 -2.976095 0.969580
C 4.761189 0.764878 1.196911
C 0.223089 -3.450305 -0.888432
C 4.434816 0.475210 -1.208646
C -4.451481 1.228513 0.743841
C -0.859521 -3.838323 -0.064186
C 5.292245 0.729188 -0.112657
C -4.968319 -0.549498 -1.028176
H 0.781896 0.393739 1.593056
H -2.256626 -0.163482 -1.519003
H -0.995023 -1.072082 1.973063
H 2.973375 0.581212 2.421532
H 1.713841 -1.936879 -1.321216
H 2.394029 0.099248 -1.861661
H -1.503098 2.884685 1.475699
H -3.938844 2.769500 2.197703
H -2.126353 -3.271269 1.619452
H 5.414049 0.979278 2.050065
H 0.567411 -4.116346 -1.687159
H 4.835068 0.479183 -2.228445
H -5.504292 1.195960 1.048683
H -1.352352 -4.804409 -0.220440
H 6.359243 0.914496 -0.278981
H -5.976848 -0.519068 -0.581980
H -5.062757 -0.280019 -2.096622
H -4.607791 -1.594057 -0.988509


