%chk=000229745.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229745

0 1
O 4.994782 0.654005 -0.732432
O 0.674048 -2.562749 0.952204
O -3.989950 2.145611 -1.905051
O -5.235063 0.800184 -0.756250
N 2.496749 0.005112 0.480335
N -4.151589 1.219344 -1.127840
C 3.469487 -1.071712 0.092601
C 3.239889 1.249940 0.869920
C 1.615570 -0.457369 1.597554
C 4.307508 -0.563255 -1.089507
C 4.087841 1.699015 -0.332770
C 0.550114 -1.361667 0.972952
C -0.668716 -0.675915 0.422624
C -0.534523 0.389646 -0.476570
C -1.937136 -1.135552 0.805731
C -1.673783 1.010446 -0.992034
C -3.082119 -0.516271 0.302845
C -2.937657 0.554941 -0.590894
H 4.138475 -1.372014 0.928046
H 2.895559 -1.978723 -0.203312
H 3.894564 1.104148 1.756209
H 2.502842 2.039632 1.126977
H 1.136220 0.414852 2.092565
H 2.150209 -1.019123 2.396328
H 5.142434 -1.244576 -1.332244
H 3.689476 -0.379577 -1.985813
H 3.458889 1.981386 -1.195404
H 4.774451 2.523994 -0.071839
H 0.463915 0.728116 -0.779259
H -2.028045 -1.985375 1.486836
H -1.591266 1.842607 -1.699873
H -4.082473 -0.858002 0.591166


%chk=000229745-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229745

0 1
O 4.741415 0.450526 -1.143594
O 0.371298 -2.153164 2.264053
O -3.751646 1.973881 -2.232777
O -4.948398 0.117737 -1.661895
N 2.476371 0.199615 0.655235
N -3.887353 0.850585 -1.611729
C 2.969466 -0.964878 -0.133683
C 3.593592 1.142286 0.944907
C 1.778254 -0.216688 1.893922
C 3.630780 -0.472000 -1.430047
C 4.244087 1.599335 -0.371050
C 0.505592 -1.051214 1.657186
C -0.599929 -0.531840 0.774500
C -0.501533 0.699513 0.070173
C -1.791758 -1.303993 0.679464
C -1.579070 1.158476 -0.711856
C -2.872997 -0.860801 -0.100148
C -2.747562 0.370079 -0.783748
H 3.704177 -1.566743 0.454980
H 2.116891 -1.622962 -0.386050
H 4.370707 0.664227 1.590775
H 3.192606 2.021110 1.485712
H 1.484048 0.700619 2.445136
H 2.424093 -0.823989 2.570988
H 4.078873 -1.309740 -1.988374
H 2.873974 0.036854 -2.065533
H 3.504315 2.167597 -0.976067
H 5.126193 2.231241 -0.177497
H 0.438640 1.256593 0.112176
H -1.843330 -2.246772 1.233108
H -1.532034 2.099886 -1.265195
H -3.799059 -1.434276 -0.189272


