%chk=000202717.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202717

0 1
O -4.762850 -0.917185 -0.070362
O 0.217899 -0.720967 1.838256
N -1.929387 -0.825568 -0.423869
C 0.439033 -0.464226 0.427373
C -0.536635 -1.370164 -0.375692
C -2.540271 -0.716239 0.940891
C -2.788903 -1.701927 -1.291084
C 1.886019 -0.820207 0.078805
C 0.248258 1.037322 0.287668
C -3.941206 -0.105938 0.798348
C -4.185975 -1.064667 -1.382297
C 2.317499 -0.805986 -1.255347
C -0.183447 1.607249 -0.917303
C 2.800180 -1.124010 1.095927
C 0.549512 1.864799 1.380735
C 3.641695 -1.122798 -1.568981
C -0.306636 2.995946 -1.027190
C 4.124235 -1.442027 0.780161
C 0.421146 3.250834 1.266873
C 4.546268 -1.447322 -0.552600
C -0.003784 3.819008 0.061406
H -0.182283 -1.445384 -1.429929
H -0.479735 -2.398890 0.043772
H -1.895095 -0.047830 1.561177
H -2.600545 -1.690219 1.469386
H -2.876112 -2.741336 -0.908657
H -2.336133 -1.756418 -2.302836
H -4.505793 -0.127413 1.746141
H -3.901431 0.921910 0.396114
H -4.150869 -0.075566 -1.872685
H -4.911629 -1.722495 -1.890760
H 0.246089 -1.679885 2.025813
H 1.625312 -0.533837 -2.051657
H -0.448774 0.973860 -1.762645
H 2.480512 -1.093025 2.139166
H 0.877060 1.415476 2.320410
H 3.970672 -1.111159 -2.606768
H -0.644281 3.435129 -1.963668
H 4.828663 -1.679440 1.575734
H 0.653811 3.888151 2.117501
H 5.577093 -1.695375 -0.798291
H -0.100384 4.898917 -0.027936


%chk=000202717-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000202717

0 1
O -4.858632 -1.061025 -0.123879
O 0.217423 -0.669190 1.956266
N -1.965007 -0.879333 -0.332948
C 0.431171 -0.412471 0.508912
C -0.556039 -1.302574 -0.312613
C -2.641854 -0.827341 0.988328
C -2.761380 -1.675901 -1.300445
C 1.886660 -0.806279 0.122492
C 0.245303 1.102128 0.321170
C -4.059592 -0.261010 0.823510
C -4.178003 -1.091012 -1.426852
C 2.327056 -0.725559 -1.224702
C -0.221928 1.646307 -0.900169
C 2.809640 -1.226127 1.111144
C 0.622447 1.982687 1.365531
C 3.646649 -1.078890 -1.576937
C -0.303006 3.045570 -1.076595
C 4.132914 -1.581565 0.759990
C 0.534264 3.381438 1.191980
C 4.556217 -1.516072 -0.585557
C 0.075780 3.919969 -0.032365
H -0.214619 -1.338590 -1.363581
H -0.425105 -2.349471 0.082571
H -2.060338 -0.183266 1.667075
H -2.702406 -1.846999 1.449913
H -2.838336 -2.748170 -0.985845
H -2.264781 -1.648368 -2.290368
H -4.612635 -0.296171 1.776455
H -3.997132 0.788456 0.464155
H -4.116779 -0.061435 -1.842190
H -4.809471 -1.718141 -2.078304
H 0.229370 -1.651572 2.094966
H 1.650450 -0.356290 -2.004349
H -0.557422 0.984579 -1.703868
H 2.498485 -1.248473 2.160245
H 0.971809 1.563016 2.313197
H 3.967700 -1.005793 -2.622182
H -0.670547 3.452365 -2.025724
H 4.832741 -1.902827 1.539966
H 0.826030 4.049707 2.010257
H 5.581409 -1.790564 -0.857886
H 0.010296 5.005356 -0.169663


