%chk=000272521.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272521

0 1
S 0.223225 1.682438 0.453942
O 0.474083 2.887686 1.546465
O 0.520847 2.057664 -1.109502
N 3.290614 0.403005 0.222995
N 0.951546 0.064780 1.003730
N -1.487525 -0.527402 -1.035370
C 2.387390 -1.823183 0.788720
C 1.826598 -2.716347 -0.389146
C 1.449000 -2.622016 1.760346
C 1.340613 -3.753151 0.680426
C 2.198172 -0.312086 0.655912
C 4.399055 -0.181142 -0.585062
C 3.540265 1.873338 0.232828
C 4.570209 0.832860 -1.756068
C 4.007256 2.189697 -1.210206
C -1.600230 1.198552 0.696640
C -2.219463 0.188459 -0.100663
C -2.281912 1.935746 1.654781
C -3.637628 -0.042204 0.124329
C -3.674273 1.687989 1.868535
C -4.337989 0.719468 1.114959
C -4.278152 -1.044211 -0.674979
C -2.139532 -1.454800 -1.761207
C -3.534710 -1.748816 -1.622001
H 3.447319 -2.053521 0.997462
H 2.543879 -3.056834 -1.155833
H 0.978208 -2.202434 -0.873106
H 0.499445 -2.080693 1.892441
H 1.870204 -2.882309 2.744907
H 0.348360 -4.206033 0.524259
H 2.080038 -4.557775 0.843016
H 4.156044 -1.196231 -0.930488
H 5.321173 -0.224357 0.029730
H 4.360810 2.049855 0.959877
H 2.679665 2.465809 0.564430
H 3.979630 0.502645 -2.627386
H 5.626447 0.904113 -2.068643
H 4.768078 2.988889 -1.213602
H 3.141602 2.520674 -1.804856
H -1.735400 2.697356 2.222758
H -4.211376 2.268269 2.625380
H -5.407047 0.531000 1.270960
H -5.346586 -1.243292 -0.531917
H -1.536141 -2.001139 -2.496487
H -3.992615 -2.517117 -2.252207


%chk=000272521-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272521

0 1
S 0.015488 1.583056 0.021174
O 0.598438 2.721328 1.060705
O -0.050166 2.014698 -1.554839
N 3.100590 0.369524 -0.246906
N 0.746301 -0.093143 0.379257
N -2.124334 -0.462397 -1.078761
C 2.360277 -1.817368 0.639664
C 2.764787 -2.856856 -0.479731
C 1.175483 -2.762440 1.030900
C 1.889907 -3.925912 0.259547
C 2.050999 -0.376458 0.220401
C 4.508461 -0.137323 -0.289133
C 3.024046 1.772747 -0.776807
C 5.351676 1.134164 -0.519558
C 4.420527 2.015350 -1.386572
C -1.728173 1.197469 0.671318
C -2.575628 0.250730 0.019813
C -2.123028 1.936581 1.777468
C -3.911889 0.082731 0.568436
C -3.439889 1.755196 2.305571
C -4.315953 0.846406 1.710979
C -4.775194 -0.860573 -0.078650
C -2.976617 -1.333298 -1.649837
C -4.313191 -1.567689 -1.188988
H 3.121374 -1.801656 1.443965
H 3.838563 -3.075543 -0.604220
H 2.334663 -2.576015 -1.457121
H 0.245277 -2.433799 0.542568
H 0.988032 -2.896722 2.107935
H 1.255338 -4.568725 -0.371265
H 2.494090 -4.566569 0.926300
H 4.632507 -0.851752 -1.126127
H 4.774578 -0.656152 0.647945
H 2.802136 2.471996 0.050967
H 2.210207 1.863824 -1.518046
H 6.315420 0.907349 -1.005863
H 5.558629 1.632823 0.445045
H 4.692940 3.083147 -1.363491
H 4.445430 1.676996 -2.438947
H -1.414323 2.647217 2.217881
H -3.751849 2.338193 3.177929
H -5.327719 0.707808 2.111041
H -5.789766 -1.013209 0.307532
H -2.592374 -1.879879 -2.519559
H -4.946876 -2.292654 -1.708820


