%chk=000213062.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213062

0 1
O -1.198394 -0.873696 -1.012909
O -4.939635 -0.862557 -1.826876
O -0.250051 -0.633716 1.063224
N 0.938772 -0.231577 -0.935895
C -3.319849 0.024231 -0.209049
C -3.177655 0.577935 1.219557
C -2.481116 -1.244461 -0.413907
C -4.796171 -0.284364 -0.521694
C -3.698006 2.005374 1.351601
C -0.160291 -0.578121 -0.144119
C 2.231655 0.121533 -0.430477
C 3.227842 0.433129 -1.378619
C 2.511188 0.164039 0.945627
C 4.501543 0.787126 -0.931973
C 3.793122 0.520956 1.366363
C 4.789802 0.833030 0.435997
H -2.947706 0.793579 -0.933122
H -2.104207 0.545528 1.518168
H -3.695266 -0.083536 1.941125
H -2.897238 -1.898477 -1.209696
H -2.306693 -1.817641 0.511614
H -5.214074 -1.068729 0.137269
H -5.423208 0.621850 -0.455106
H -3.177476 2.691647 0.673366
H -4.769800 2.077146 1.138070
H -3.544223 2.382805 2.370550
H -4.620434 -0.245664 -2.514722
H 0.816106 -0.254064 -1.953023
H 3.017219 0.400640 -2.444134
H 1.737359 -0.079957 1.680515
H 5.276893 1.029233 -1.658866
H 4.015307 0.555055 2.433459
H 5.785288 1.109722 0.774679


%chk=000213062-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213062

0 1
O -1.168298 -0.531754 -1.021955
O -5.302964 -1.275336 -1.466179
O -0.099284 -1.046658 1.024093
N 1.012839 -0.016320 -0.801116
C -3.482277 0.027550 -0.315900
C -3.157476 0.891701 0.931448
C -2.453015 -1.097800 -0.527789
C -4.893330 -0.601114 -0.220947
C -3.907612 2.241793 0.976652
C -0.068017 -0.576133 -0.140364
C 2.337364 0.166751 -0.316211
C 3.274135 0.772845 -1.196324
C 2.743551 -0.223454 0.987488
C 4.602992 0.988004 -0.779060
C 4.078394 0.000329 1.388692
C 5.015190 0.603429 0.518345
H -3.453368 0.683573 -1.213299
H -2.069093 1.087160 0.952149
H -3.376581 0.304871 1.847028
H -2.791435 -1.790975 -1.315320
H -2.257389 -1.647306 0.411568
H -4.910689 -1.402466 0.539024
H -5.636761 0.168302 0.069736
H -3.672877 2.852860 0.084470
H -5.005006 2.110657 1.015692
H -3.613830 2.824411 1.868506
H -5.371859 -0.597544 -2.185345
H 0.814930 0.293704 -1.755060
H 2.961551 1.074605 -2.204377
H 2.021808 -0.690946 1.660339
H 5.314996 1.456029 -1.467846
H 4.386534 -0.303240 2.395589
H 6.047479 0.770470 0.843273


