%chk=000240778.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240778

0 1
O -4.053326 -0.241857 -0.199201
O -3.233212 -1.043822 1.720937
O 2.197005 -1.170493 1.949290
O 1.235024 -2.712159 -1.701750
N 1.594323 -0.976832 -0.242291
C -2.169674 1.019559 -1.036884
C -1.826843 0.369618 0.270393
C 0.517285 1.148551 0.477518
C -3.618809 0.588054 -1.322086
C -0.671039 0.409057 0.936902
C 1.626693 0.472214 -0.069820
C -3.031490 -0.384980 0.738639
C 0.575983 2.543256 0.619097
C 2.777283 1.176124 -0.456547
C 1.717835 3.245733 0.227824
C 2.816711 2.563592 -0.305798
C 1.945835 -1.769702 0.929099
C 1.212175 -1.514151 -1.516650
C 1.959568 -3.247059 0.774317
C 0.790981 -0.525641 -2.560257
H -2.072587 2.120864 -0.978012
H -1.471238 0.690404 -1.840066
H -4.335264 1.424265 -1.353977
H -3.728108 -0.052071 -2.211800
H -0.537273 -0.125787 1.890731
H -0.272044 3.075653 1.051257
H 3.639207 0.639617 -0.853269
H 1.756293 4.328223 0.348639
H 3.711311 3.114498 -0.596725
H 0.974318 -3.646879 0.471053
H 2.649371 -3.582968 -0.020574
H 2.251372 -3.738572 1.715078
H 1.573259 0.213336 -2.786571
H 0.552925 -1.048311 -3.501614
H -0.113948 0.035667 -2.255382


%chk=000240778-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240778

0 1
O -4.420742 -0.083147 -0.083758
O -3.038278 -1.832600 -0.763094
O 1.411845 -0.798123 2.048635
O 2.433331 -3.097170 -1.309374
N 1.813699 -1.095955 -0.221296
C -2.808364 1.749166 -0.028824
C -2.122587 0.435629 -0.339280
C 0.383851 0.954616 -0.468067
C -4.234394 1.311769 0.410492
C -0.806970 0.099676 -0.502315
C 1.676533 0.354109 -0.343546
C -3.163685 -0.638796 -0.432636
C 0.332137 2.375559 -0.580838
C 2.845654 1.137544 -0.304810
C 1.502433 3.158574 -0.558021
C 2.767067 2.542678 -0.413149
C 1.640983 -1.617810 1.122218
C 2.148711 -1.873425 -1.380203
C 1.718420 -3.110439 1.354092
C 2.130899 -1.129492 -2.710226
H -2.295544 2.324056 0.761861
H -2.863112 2.390631 -0.929919
H -4.342062 1.287617 1.508753
H -5.040022 1.917931 -0.030530
H -0.631098 -0.973991 -0.663204
H -0.631926 2.870962 -0.716597
H 3.813197 0.641237 -0.173625
H 1.430732 4.247427 -0.652027
H 3.679106 3.147539 -0.380446
H 1.023451 -3.662172 0.698938
H 2.722759 -3.501173 1.120925
H 1.473018 -3.290501 2.411905
H 2.927854 -0.366860 -2.757391
H 2.291703 -1.868819 -3.508225
H 1.171305 -0.609247 -2.874919


