%chk=000206256.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206256

0 1
S 1.119541 1.692866 -0.146062
O 1.418518 2.379474 1.089130
O 1.334780 2.382665 -1.405184
N -0.562142 1.266305 -0.120152
N -0.551285 -0.260993 1.788579
C -1.157191 0.440749 0.880484
C -2.673621 0.326127 0.888698
C 1.901790 0.161855 -0.180434
C -3.171142 -0.627103 -0.205533
C 1.742012 -0.721091 0.896521
C 0.881914 -0.321902 2.073466
C -4.699187 -0.760353 -0.176712
C -1.427839 1.986129 -1.087925
C 2.698158 -0.192744 -1.274139
C 2.389341 -1.964296 0.873271
C -5.200660 -1.697992 -1.272152
C 3.344587 -1.430239 -1.294863
C 3.187477 -2.313222 -0.219313
H -3.138376 1.326739 0.794412
H -2.999829 -0.052583 1.886080
H -2.839774 -0.265991 -1.202719
H -2.700636 -1.622162 -0.071868
H 0.975126 -1.070561 2.902119
H 1.251544 0.644810 2.517604
H -5.170086 0.235468 -0.291852
H -5.025329 -1.135942 0.813858
H -2.014948 2.780454 -0.597775
H -2.124602 1.283925 -1.586693
H -0.817372 2.458698 -1.884791
H 2.814340 0.502067 -2.115013
H 2.263647 -2.660519 1.701795
H -4.782220 -2.705657 -1.164084
H -4.931176 -1.337163 -2.271127
H -6.292217 -1.793348 -1.241821
H 3.967124 -1.707559 -2.143785
H 3.690335 -3.281813 -0.235122


%chk=000206256-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000206256

0 1
S 1.223605 1.828546 -0.094381
O 1.612603 2.608816 1.278361
O 1.486423 2.567851 -1.520638
N -0.620413 1.344776 -0.127431
N -0.601813 -0.230551 1.794118
C -1.179784 0.513288 0.884634
C -2.710292 0.393847 0.815478
C 1.977375 0.104469 -0.170553
C -3.173361 -0.686957 -0.197125
C 1.719599 -0.756445 0.913208
C 0.847086 -0.327186 2.090498
C -4.711577 -0.835501 -0.231118
C -1.405547 2.243589 -0.996679
C 2.748810 -0.212252 -1.295604
C 2.293995 -2.048777 0.823176
C -5.181471 -1.928928 -1.214573
C 3.313336 -1.508638 -1.348943
C 3.083886 -2.418649 -0.290885
H -3.182113 1.364234 0.577147
H -3.032313 0.099987 1.828266
H -2.805095 -0.448809 -1.216178
H -2.709369 -1.651390 0.087166
H 0.952333 -1.078845 2.890972
H 1.223757 0.638681 2.488973
H -5.169054 0.136342 -0.508842
H -5.076764 -1.071600 0.788866
H -1.910096 3.051998 -0.435298
H -2.152998 1.656058 -1.556000
H -0.714663 2.696271 -1.730823
H 2.894147 0.522138 -2.094142
H 2.117263 -2.761708 1.636385
H -4.764180 -2.915373 -0.938343
H -4.853598 -1.703538 -2.246947
H -6.283214 -2.018124 -1.222034
H 3.922621 -1.800746 -2.210068
H 3.521478 -3.421777 -0.333745


