%chk=000272446.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272446

0 1
O -3.680787 -1.905305 0.099172
O -2.487107 2.262894 0.237373
O -3.663076 0.727102 1.427810
O 1.982908 -2.940112 1.116947
O -0.155882 -2.809423 0.855794
O 4.154864 2.498142 -0.762489
O 4.936269 0.634142 0.012242
N -1.262492 -0.662936 -0.108132
N 0.978077 -2.337525 0.786423
N 4.022068 1.358459 -0.344075
C -2.437294 0.066896 -0.611029
C -3.574612 -0.957648 -0.964150
C 0.012853 -0.175128 -0.148399
C -3.245598 -1.773343 -2.200144
C -2.950239 1.003932 0.495487
C 1.126119 -0.979950 0.277265
C 0.286492 1.157209 -0.612678
C 2.435340 -0.463393 0.207614
C 2.659144 0.823771 -0.265903
C 1.566667 1.641580 -0.673454
C -2.829763 3.310385 1.191875
H -2.184147 0.672825 -1.525348
H -4.537690 -0.406524 -1.070637
H -1.468499 -1.624437 0.274748
H -3.159846 -1.157855 -3.101103
H -4.030306 -2.527144 -2.377251
H -2.312530 -2.344438 -2.081807
H -0.548596 1.805394 -0.894903
H 3.285165 -1.093176 0.532825
H -4.029394 -1.469919 0.922600
H 1.777667 2.659672 -1.029098
H -2.166234 3.215449 2.057451
H -3.880340 3.227694 1.491172
H -2.634900 4.226510 0.623300


%chk=000272446-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272446

0 1
O -3.733607 -1.871813 0.167200
O -2.607775 2.352397 0.255334
O -3.701269 0.683700 1.454253
O 2.034977 -3.022686 1.088465
O -0.223699 -2.813327 0.901709
O 4.284468 2.478170 -0.875767
O 5.062927 0.495795 -0.045261
N -1.258029 -0.621539 -0.115463
N 0.990327 -2.339240 0.772572
N 4.105849 1.278877 -0.420197
C -2.442000 0.094022 -0.603265
C -3.546496 -0.956337 -0.962168
C 0.032358 -0.163667 -0.163456
C -3.173115 -1.813447 -2.173451
C -2.990206 1.042720 0.483118
C 1.159539 -0.978376 0.249553
C 0.340228 1.160296 -0.638967
C 2.485033 -0.505653 0.162870
C 2.722818 0.783636 -0.327557
C 1.649506 1.625084 -0.726464
C -3.059732 3.358815 1.260155
H -2.194917 0.691174 -1.498030
H -4.482637 -0.393413 -1.167551
H -1.411625 -1.560988 0.298064
H -3.041753 -1.191377 -3.076832
H -3.977588 -2.543087 -2.361776
H -2.242629 -2.375495 -1.985874
H -0.479355 1.830428 -0.906519
H 3.311788 -1.148425 0.475962
H -4.028035 -1.335039 0.955213
H 1.872617 2.632379 -1.087911
H -2.661439 3.097492 2.253688
H -4.160872 3.379986 1.296268
H -2.651357 4.312737 0.901586


