%chk=000273339.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273339

0 1
O 1.378224 2.384634 -1.914471
O -2.545277 2.110327 0.967696
O 1.182195 1.019614 2.107699
O -0.925957 -2.709503 0.958284
O -0.627294 -1.421982 -0.850119
O 3.075722 -1.928537 -1.267466
O 1.935179 -2.679566 0.504318
N -0.874433 1.327193 -0.389033
N 2.109375 0.597360 0.063775
N -4.472679 0.357932 -0.061000
C 0.175574 2.164901 0.222831
C -3.036376 0.083777 -0.287028
C -2.149093 1.265445 0.187248
C 0.804375 3.109685 -0.817956
C -2.652476 -1.180886 0.504069
C 1.197305 1.225898 0.909486
C 3.005171 -0.446284 0.576412
C -1.323934 -1.741058 0.098355
C 2.581513 -1.790164 -0.000096
H -0.288533 2.797690 1.045711
H -2.879831 -0.101067 -1.385889
H -0.539924 0.558154 -0.990913
H 1.671416 3.654662 -0.393029
H 0.058362 3.831778 -1.197289
H -2.669970 -0.994070 1.604242
H -3.446533 -1.957538 0.357179
H 2.194544 0.847634 -0.932318
H -4.642912 0.644368 0.904465
H -4.793250 1.119869 -0.655011
H 2.950418 -0.494696 1.699876
H 4.065279 -0.229101 0.299638
H 0.674472 2.089220 -2.533547
H 0.019059 -3.044686 0.772251
H 2.792889 -2.777001 -1.710569


%chk=000273339-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000273339

0 1
O 1.401042 2.506057 -1.887686
O -2.493846 1.958458 0.985491
O 1.405944 0.843945 2.169172
O -0.734463 -2.472595 1.336984
O -0.673106 -1.892871 -0.905346
O 1.856485 -1.661704 -1.214326
O 1.846875 -2.381152 0.987642
N -0.692265 1.160292 -0.266172
N 2.403607 0.770118 0.054842
N -4.318680 0.291880 -0.384812
C 0.312555 2.073726 0.332610
C -2.888918 -0.041567 -0.410759
C -2.013172 1.118535 0.168751
C 0.796275 3.129911 -0.683875
C -2.662269 -1.351980 0.409874
C 1.438593 1.203027 0.957838
C 3.220417 -0.422137 0.343818
C -1.279044 -1.936322 0.223610
C 2.296883 -1.620225 0.080444
H -0.191525 2.591231 1.167899
H -2.586088 -0.250016 -1.453319
H -0.363237 0.405528 -0.878554
H 1.597649 3.746557 -0.245122
H -0.047926 3.782119 -0.975140
H -2.848942 -1.190237 1.484439
H -3.413665 -2.075747 0.043022
H 2.335411 1.123595 -0.913801
H -4.577707 0.747385 0.501216
H -4.611361 0.870412 -1.179994
H 3.522948 -0.431509 1.400868
H 4.103296 -0.442064 -0.313803
H 0.684780 2.261867 -2.524622
H 0.277052 -2.669647 1.237580
H 0.899004 -2.050868 -1.250967


