%chk=000231098.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231098

0 1
O -4.913454 0.297807 -0.057276
O 0.570831 -4.785926 0.025405
O 4.310449 2.971103 0.346385
N 0.802379 3.041554 -0.033556
N 2.856896 1.131072 0.250663
N 2.083914 3.422368 0.061889
C 0.519648 1.740946 0.001576
C 1.596006 0.738997 0.130140
C -0.908098 1.375672 -0.058966
C 1.331819 -0.709000 0.135225
C -1.477708 0.608891 0.980005
C -1.704685 1.812216 -1.125909
C 0.403731 -1.278070 -0.764375
C 2.052797 -1.541378 1.009852
C -2.821486 0.268749 0.942516
C -3.060921 1.477758 -1.184196
C 0.178730 -2.645419 -0.771350
C 1.833885 -2.919311 1.026798
C -3.605206 0.709593 -0.147966
C 0.897627 -3.459331 0.134167
C 3.206182 2.500410 0.237742
C -5.827438 0.700898 -1.106534
C 1.256564 -5.731704 0.884446
H -0.855069 0.280680 1.813988
H -1.266181 2.422206 -1.917632
H -0.137389 -0.638098 -1.465890
H 2.796240 -1.103864 1.683797
H -3.285360 -0.323292 1.729028
H -3.665735 1.820345 -2.016902
H -0.532198 -3.105625 -1.454897
H 2.392560 -3.546272 1.713922
H 2.244686 4.439581 0.021652
H -5.511809 0.283411 -2.066732
H -5.910769 1.790968 -1.140171
H -6.768125 0.245064 -0.769548
H 1.037229 -5.518697 1.934472
H 2.330867 -5.721770 0.678496
H 0.804793 -6.683029 0.572537


%chk=000231098-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231098

0 1
O -5.220019 0.637190 -0.121089
O 0.975948 -5.053546 0.096703
O 4.113956 2.967387 0.874028
N 0.779211 2.861474 -0.464411
N 2.712823 1.075618 0.576240
N 2.086392 3.203877 -0.264818
C 0.424234 1.598322 -0.141612
C 1.479438 0.641379 0.256003
C -1.033160 1.317129 -0.186461
C 1.296355 -0.831614 0.248898
C -1.656090 0.482405 0.785862
C -1.854683 1.951491 -1.152716
C 0.382735 -1.496413 -0.622185
C 2.137378 -1.624652 1.075797
C -3.044564 0.279938 0.779215
C -3.250278 1.751865 -1.176183
C 0.309513 -2.896151 -0.652979
C 2.059517 -3.029089 1.070603
C -3.849857 0.910613 -0.204052
C 1.140072 -3.670851 0.199194
C 3.054539 2.430629 0.458415
C -6.104878 1.282564 -1.095967
C 1.825493 -5.910219 0.933176
H -1.051157 -0.002931 1.557992
H -1.387510 2.611378 -1.890703
H -0.258081 -0.919172 -1.293999
H 2.861324 -1.111692 1.716281
H -3.529918 -0.354141 1.526855
H -3.851114 2.249721 -1.942948
H -0.376907 -3.414594 -1.328586
H 2.711451 -3.607212 1.731731
H 2.329937 4.163906 -0.523088
H -5.862186 0.967880 -2.129427
H -6.049671 2.385649 -1.019270
H -7.116712 0.942074 -0.832670
H 1.643120 -5.725519 2.009044
H 2.896911 -5.756725 0.702878
H 1.532637 -6.938467 0.677051


