%chk=000252057.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252057

0 1
O 4.214114 -0.615925 0.049930
O -2.107502 -2.207747 -0.228652
O 4.505575 -2.672660 -0.908318
N -1.375111 -0.024979 -0.023793
C 0.890682 0.925109 0.186984
C 2.297445 0.747296 0.183630
C 0.040880 -0.233461 -0.020037
C 2.815637 -0.579849 -0.018978
C 0.595830 -1.484300 -0.211976
C 0.379563 2.244416 0.394956
C 3.159049 1.869210 0.380790
C 2.002827 -1.667016 -0.211547
C 1.225137 3.310874 0.583439
C 2.635566 3.123260 0.575503
C -2.363601 -1.025226 -0.133863
C -3.755918 -0.464453 -0.108686
C -4.602215 -0.802139 0.954798
C -4.214042 0.345643 -1.155281
C -5.911261 -0.311865 0.976025
C -5.525391 0.828356 -1.129565
C 4.978776 -1.684343 -0.416495
C -6.371701 0.502653 -0.063815
C 6.403775 -1.328314 -0.174566
H -0.038094 -2.367678 -0.367747
H -0.699620 2.401259 0.405473
H 4.236898 1.695569 0.372060
H 2.406434 -2.670804 -0.375070
H -1.681571 0.947571 0.088368
H 0.829724 4.313476 0.742041
H 3.283853 3.984733 0.726228
H -4.242787 -1.451123 1.754995
H -3.557697 0.587556 -1.991354
H -6.573993 -0.570725 1.801030
H -5.889484 1.454745 -1.942869
H -7.393729 0.880572 -0.046476
H 6.519834 -0.366627 0.351368
H 6.953269 -1.257509 -1.127492
H 6.900051 -2.104353 0.430959


%chk=000252057-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000252057

0 1
O 4.285107 -0.608896 -0.070229
O -2.185284 -2.247777 0.182617
O 4.634033 -2.939141 -0.187836
N -1.373149 -0.040797 0.073660
C 0.886667 0.937580 0.102750
C 2.323749 0.759815 0.051716
C 0.032596 -0.236853 0.057391
C 2.857855 -0.575152 -0.028334
C 0.607366 -1.515429 -0.011561
C 0.381413 2.277907 0.197578
C 3.178851 1.909212 0.085443
C 2.019178 -1.690583 -0.055110
C 1.235690 3.382869 0.230953
C 2.649226 3.197708 0.170913
C -2.392854 -0.998354 0.092995
C -3.789661 -0.433095 0.021738
C -4.840100 -1.227505 0.548931
C -4.100706 0.817709 -0.576610
C -6.172342 -0.768481 0.508817
C -5.436392 1.274126 -0.620878
C 5.079318 -1.775522 -0.145566
C -6.474368 0.486712 -0.071302
C 6.536733 -1.369246 -0.164928
H -0.045748 -2.388882 -0.027724
H -0.695978 2.473265 0.260750
H 4.259188 1.750520 0.044309
H 2.434275 -2.696483 -0.110815
H -1.688828 0.928418 0.103878
H 0.819645 4.393117 0.307163
H 3.314830 4.066912 0.196172
H -4.585469 -2.202624 0.976547
H -3.321402 1.422144 -1.058350
H -6.974664 -1.386997 0.925290
H -5.668490 2.233810 -1.095378
H -7.509984 0.842336 -0.106378
H 6.788210 -0.808044 0.751745
H 6.736667 -0.705222 -1.023621
H 7.166026 -2.267873 -0.234740


