%chk=000203394.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203394

0 1
S -0.473165 -1.252379 1.314879
O -0.000810 -2.620768 1.214380
O -0.181384 -0.509571 2.520765
O -3.849531 -1.899459 -0.540346
N -1.799503 -1.529201 -1.371651
C 0.093701 -0.357186 -0.150042
C -0.345627 -1.250532 -1.333105
C -2.217684 -1.251011 1.077870
C -0.531828 1.023775 -0.129936
C 1.610136 -0.273078 -0.198973
C -2.694039 -1.594579 -0.299491
C -0.337534 1.847149 0.995922
C 2.239517 0.896162 -0.656551
C -1.268880 1.525214 -1.212309
C 2.403285 -1.376823 0.156140
C -0.896091 3.124152 1.046225
C 3.633265 0.970183 -0.728086
C -1.828931 2.806648 -1.157704
C 3.796143 -1.297361 0.084480
C -1.648922 3.608441 -0.029369
C 4.417252 -0.124393 -0.354358
H -0.051138 -0.764434 -2.294076
H 0.211272 -2.225153 -1.288261
H -2.672122 -0.271951 1.372393
H -2.718387 -1.951533 1.794894
H -2.175966 -1.770040 -2.293164
H 0.256312 1.492634 1.850032
H 1.648626 1.762171 -0.958466
H -1.418466 0.932310 -2.112963
H 1.953509 -2.319712 0.496989
H -0.741962 3.745574 1.928619
H 4.107513 1.886857 -1.076573
H -2.407264 3.177194 -2.003532
H 4.398482 -2.158217 0.375100
H -2.087362 4.604015 0.013204
H 5.502881 -0.064699 -0.404835


%chk=000203394-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000203394

0 1
S -0.477355 -1.283224 1.474443
O -0.014461 -2.857378 1.326700
O -0.199758 -0.487845 2.877126
O -3.906449 -2.050427 -0.564377
N -1.801049 -1.525784 -1.357930
C 0.171670 -0.239059 -0.306567
C -0.341639 -1.269581 -1.330737
C -2.366737 -1.247819 1.089834
C -0.524065 1.093803 -0.226832
C 1.686451 -0.216345 -0.262748
C -2.723313 -1.657766 -0.334722
C -0.269249 1.948594 0.885537
C 2.395064 0.986759 -0.537003
C -1.408050 1.546297 -1.244521
C 2.432481 -1.407125 -0.021039
C -0.887228 3.212117 0.975357
C 3.805472 0.999333 -0.573889
C -2.011852 2.819377 -1.158709
C 3.841813 -1.383333 -0.043777
C -1.758901 3.655363 -0.047100
C 4.536216 -0.184266 -0.325961
H -0.055776 -0.904771 -2.336620
H 0.202066 -2.218532 -1.160933
H -2.681604 -0.212521 1.296351
H -2.822434 -1.945615 1.808192
H -2.179796 -1.828346 -2.261722
H 0.396599 1.609703 1.685330
H 1.843160 1.910904 -0.732185
H -1.623128 0.913420 -2.109978
H 1.913741 -2.338209 0.233893
H -0.689604 3.849024 1.844081
H 4.331915 1.934269 -0.794865
H -2.682804 3.155190 -1.956766
H 4.398493 -2.303086 0.166052
H -2.236029 4.639047 0.021811
H 5.631438 -0.171769 -0.347625


