%chk=000207147.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207147

0 1
O -0.873366 1.745315 1.569624
O -3.705671 0.171280 0.018359
O 1.225561 2.581134 1.547858
O -2.588678 -1.481630 -1.125648
N 0.792932 0.335524 0.872841
N -4.805990 -1.738293 -0.457818
C -1.573395 0.540117 1.135494
C -0.466986 -0.449060 0.707181
C -2.508947 0.994709 0.009091
C 1.924695 0.039395 0.024601
C 0.505219 1.650875 1.314330
C 2.589632 -1.201998 0.155616
C 2.373926 0.999900 -0.898589
C 3.686737 -1.458309 -0.682078
C 2.168194 -2.230173 1.152148
C 3.476183 0.724201 -1.707706
C 4.127235 -0.508847 -1.605819
C -3.602876 -1.070809 -0.599528
H -2.146131 0.199109 2.024779
H -0.435660 -1.336138 1.374988
H -0.604940 -0.830935 -0.331818
H -2.041758 0.970648 -0.991008
H -2.926715 2.002860 0.215569
H 1.877535 1.968327 -0.971516
H 4.207688 -2.412205 -0.602986
H 1.879298 -1.769900 2.110158
H 1.310737 -2.812360 0.786045
H 2.971109 -2.945447 1.377124
H 3.827075 1.471999 -2.417444
H 4.982876 -0.727376 -2.242840
H -5.619456 -1.264272 -0.093966
H -4.963062 -2.582439 -0.990543


%chk=000207147-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207147

0 1
O -0.810176 1.669772 1.815527
O -3.719920 0.062943 0.152058
O 1.319408 2.567014 1.415021
O -2.618196 -1.209404 -1.510701
N 0.714112 0.363458 0.711657
N -4.826011 -1.651153 -0.844498
C -1.569004 0.480201 1.332398
C -0.473924 -0.513276 0.844898
C -2.554276 0.973723 0.254719
C 1.878202 0.028885 -0.068528
C 0.526699 1.617394 1.301442
C 2.600821 -1.175599 0.173402
C 2.293561 0.929842 -1.080610
C 3.712458 -1.457490 -0.660821
C 2.245264 -2.121161 1.306428
C 3.415628 0.636746 -1.880658
C 4.121688 -0.570964 -1.679954
C -3.633866 -0.968888 -0.810439
H -2.139940 0.088801 2.190569
H -0.305590 -1.309423 1.591326
H -0.743506 -0.969881 -0.121963
H -2.066720 1.073022 -0.731443
H -2.981266 1.936955 0.573760
H 1.738552 1.861604 -1.226028
H 4.276835 -2.381783 -0.488423
H 2.001056 -1.565405 2.229894
H 1.375326 -2.760347 1.059969
H 3.091302 -2.793549 1.527868
H 3.730333 1.341983 -2.657166
H 4.990275 -0.813823 -2.301642
H -5.603170 -1.362115 -0.255140
H -4.922952 -2.432879 -1.486423


