%chk=000228829.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228829

0 1
O 0.338767 -2.022534 -1.475952
O -0.558640 0.568237 -2.114870
O 1.826749 -2.254638 0.953819
O 2.582508 2.252569 0.755892
O -1.735011 1.233038 0.859395
N -0.905144 -1.314950 0.343541
N 1.043471 1.392127 -0.729511
N 2.193992 -0.016882 0.857402
N -2.166153 -0.889339 -0.134523
N -3.893901 0.687066 0.302749
C 0.293613 -1.009918 -0.480929
C 0.191964 0.368887 -1.188708
C 1.488562 -1.191283 0.500749
C 1.970796 1.293853 0.349686
C -2.525113 0.431576 0.401283
H -0.959454 -2.351977 0.484209
H 0.895166 2.342554 -1.115553
H 2.912403 -0.100954 1.598682
H 1.158494 -2.005016 -2.020711
H -2.305604 -0.972036 -1.163870
H -4.253169 1.496186 0.795162
H -4.558997 -0.055267 0.146859


%chk=000228829-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228829

0 1
O 1.223656 -1.832075 -1.426663
O -0.608968 0.485520 -2.324594
O 1.038945 -1.885980 1.570758
O 2.555531 2.384282 0.503963
O -1.245409 0.464137 1.285906
N -0.955282 -1.708682 -0.444183
N 1.015524 1.362657 -0.918627
N 1.852788 0.208388 0.980354
N -2.149993 -0.963028 -0.339686
N -3.482625 0.704926 0.645153
C 0.328463 -1.001618 -0.597648
C 0.161028 0.341505 -1.337693
C 1.080807 -0.932824 0.756516
C 1.859166 1.381673 0.212836
C -2.241109 0.100508 0.583637
H -0.874873 -2.413846 0.304991
H 1.006588 2.231085 -1.463609
H 2.398028 0.244084 1.847540
H 0.662197 -2.182898 -2.169813
H -2.697968 -0.930848 -1.201772
H -3.579060 1.522220 1.243014
H -4.312136 0.302114 0.214421


