%chk=000259598.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259598

0 1
O 4.566162 -0.795579 -1.866817
O 4.285150 0.303333 0.066943
O -2.180800 -1.327300 2.048667
O 1.394069 -3.410077 -1.021165
O 0.496645 3.504318 0.589838
O 0.660424 3.292454 -1.628564
O 0.006193 -0.614621 2.028130
N 1.885054 -1.475845 0.112062
N -0.585751 -2.825175 1.549931
C 2.335691 -0.735661 -1.079224
C 1.488688 0.521717 -1.346659
C 1.415068 1.471388 -0.149729
C 3.795265 -0.332013 -0.834697
C 1.361097 -2.764358 0.006985
C 0.784291 -3.312486 1.327607
C 0.847326 2.795520 -0.542807
C -2.929900 0.605066 0.816365
C -2.650072 0.058572 2.185613
C -0.823690 -1.496643 1.875977
C -2.209031 1.705156 0.332770
C -3.911521 0.003492 0.014096
C -2.467717 2.198039 -0.949729
C -4.168330 0.501648 -1.265430
C -3.446458 1.598641 -1.748380
H 2.292158 -1.419785 -1.984501
H 0.461982 0.208292 -1.638925
H 1.890778 1.057091 -2.236376
H 0.807618 1.027071 0.682395
H 2.425684 1.628401 0.309335
H 1.729218 -0.914601 0.966781
H 1.441128 -3.044703 2.191088
H 0.772614 -4.428221 1.269303
H -1.358771 -3.445428 1.316714
H -1.903152 0.642252 2.756558
H -3.565032 -0.092414 2.791168
H 5.531074 -0.565274 -1.770447
H -1.443741 2.178159 0.953134
H -4.464852 -0.857319 0.388048
H 0.156143 4.414820 0.383746
H -1.898183 3.046365 -1.333685
H -4.929740 0.034172 -1.888100
H -3.644680 1.984836 -2.747618


%chk=000259598-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259598

0 1
O 4.440399 -0.398981 -2.106088
O 4.438547 -0.753122 0.192123
O -2.391882 -1.663733 1.919203
O 2.271763 -3.446408 -0.575543
O 2.041384 4.121004 0.338017
O 0.297030 3.309893 -0.954086
O -0.284217 -0.605681 2.046481
N 1.622280 -1.298350 0.056794
N -0.513132 -2.875742 1.513096
C 2.282047 -0.650465 -1.072071
C 1.736083 0.785317 -1.295112
C 2.045417 1.758114 -0.133522
C 3.809341 -0.629325 -0.876026
C 1.667081 -2.665378 0.219651
C 0.929404 -3.174409 1.482087
C 1.356391 3.094902 -0.321813
C -3.350593 0.315246 0.733310
C -3.074521 -0.324021 2.074923
C -1.001578 -1.635029 1.837673
C -2.432910 1.243466 0.177356
C -4.528516 -0.007882 0.011455
C -2.680867 1.835928 -1.081230
C -4.780667 0.582232 -1.246559
C -3.856959 1.504401 -1.793926
H 2.099893 -1.245382 -1.985858
H 0.643471 0.721746 -1.445718
H 2.172772 1.177665 -2.230138
H 1.688811 1.353945 0.836113
H 3.128466 1.929212 -0.010361
H 1.122857 -0.744579 0.771573
H 1.407669 -2.730819 2.375416
H 1.062464 -4.266191 1.515844
H -1.187766 -3.603105 1.273957
H -2.430546 0.306511 2.710645
H -3.999322 -0.594729 2.607535
H 5.427231 -0.391406 -1.976894
H -1.521876 1.496437 0.731380
H -5.244784 -0.722617 0.435586
H 1.541071 4.975885 0.229669
H -1.954911 2.546503 -1.488685
H -5.693875 0.328653 -1.796606
H -4.054851 1.963595 -2.769251


