%chk=000269684.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269684

0 1
O -4.612252 -0.053690 0.102043
O 1.797511 -0.242075 0.459359
O -3.236872 1.507721 0.974557
O 5.157982 -0.396193 -0.527262
O 3.825653 -1.888557 0.315377
N -2.412107 -0.695172 0.505963
N -1.143410 -0.327699 -0.066391
N 4.080530 -0.772781 -0.096163
C -3.058536 -1.858043 -0.194899
C -4.522667 -1.424176 -0.392685
C -0.428241 0.600095 0.886399
C -3.376038 0.400754 0.533672
C 0.930711 0.851825 0.353415
C 1.569400 1.931445 -0.220542
C 2.912790 1.524369 -0.501091
C 3.012659 0.213311 -0.084005
H -2.974852 -2.738180 0.480316
H -2.572711 -2.124749 -1.156917
H -4.842447 -1.376780 -1.446772
H -5.243487 -2.000039 0.211397
H -0.379935 0.211779 1.934137
H -1.008489 1.564437 0.943512
H -0.578185 -1.200582 -0.145609
H 1.148873 2.899684 -0.432470
H 3.687821 2.125794 -0.951340


%chk=000269684-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000269684

0 1
O -4.178689 0.814214 0.064353
O 2.312156 -0.578553 0.353804
O -2.074263 1.669838 -0.529951
O 5.280938 1.371239 -0.142587
O 5.016219 -0.822039 0.499561
N -2.433988 -0.645631 -0.107901
N -1.192683 -1.145194 -0.520843
N 4.554874 0.333375 0.147615
C -3.606998 -1.538068 0.040816
C -4.675896 -0.525508 0.523390
C -0.083213 -1.139405 0.469303
C -2.800564 0.706121 -0.218504
C 0.986238 -0.112895 0.198474
C 1.000987 1.228515 -0.189057
C 2.377154 1.631562 -0.275993
C 3.134321 0.515852 0.063221
H -3.412863 -2.330960 0.780876
H -3.864842 -2.008300 -0.927347
H -5.667439 -0.675562 0.073213
H -4.754247 -0.489996 1.623127
H 0.403103 -2.132755 0.494133
H -0.540325 -0.976154 1.462720
H -0.929510 -0.849578 -1.469253
H 0.110548 1.825014 -0.383902
H 2.772682 2.607367 -0.545267


