%chk=000261327.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261327

0 1
O -3.396753 -2.563573 -0.771691
O -1.103984 1.623499 2.009771
O -2.466445 -2.481778 1.302018
O 0.462791 0.285837 1.065434
O 3.448323 -3.698283 -2.380739
O 4.846862 5.679622 2.015177
O 2.295396 -5.085366 -3.574645
O 3.291570 6.726999 3.096270
N -3.620507 0.204506 -0.123370
N 2.403437 -4.238871 -2.702705
N 3.720301 5.772760 2.470306
C -4.187692 0.843479 -1.356480
C -4.584358 -0.752646 0.503695
C -3.170523 1.234090 0.866514
C -3.029779 1.352121 -2.233995
C -4.679565 -2.045675 -0.317608
C -2.147720 0.608188 1.821495
C -3.547646 1.958740 -3.533533
C -2.356712 -2.674576 0.112898
C 0.162592 1.344645 1.570017
C -1.130872 -3.086342 -0.636386
C 1.062249 2.509304 1.818950
C 0.092391 -2.499929 -0.286711
C 2.370910 2.447771 1.315348
C -1.210358 -4.042098 -1.659936
C 0.619669 3.629876 2.536308
C 1.254992 -2.875622 -0.963765
C 3.245396 3.515061 1.526486
C -0.052567 -4.425209 -2.337237
C 1.488512 4.700971 2.752427
C 1.169962 -3.836266 -1.980510
C 2.792561 4.631234 2.243235
H -4.761025 0.078407 -1.924941
H -4.897161 1.667262 -1.131832
H -4.209974 -1.013556 1.524878
H -5.606258 -0.335510 0.637162
H -4.003504 1.698315 1.434830
H -2.673071 2.069425 0.314450
H -2.425784 2.097178 -1.679366
H -2.337188 0.511833 -2.449237
H -5.167689 -2.848794 0.262610
H -5.183597 -1.901102 -1.293125
H -2.527937 0.455311 2.844793
H -1.706243 -0.334681 1.434674
H -2.719024 2.320996 -4.154451
H -4.213912 2.809520 -3.352418
H -4.101589 1.226475 -4.132456
H 0.139659 -1.741360 0.509129
H 2.699693 1.561604 0.761062
H -2.177242 -4.474783 -1.928337
H -0.404447 3.659138 2.923288
H 2.221750 -2.427417 -0.707278
H 4.271917 3.488132 1.141825
H -0.087583 -5.171104 -3.138726
H 1.164376 5.586844 3.310829


%chk=000261327-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000261327

0 1
O -3.632063 -2.615362 -0.540522
O -1.120726 1.862272 2.062046
O -2.385652 -2.472133 1.424597
O 0.520179 0.398998 1.256898
O 3.357838 -3.516493 -2.557176
O 5.242928 5.478239 2.548217
O 2.014468 -4.069085 -4.315484
O 3.570034 6.822835 3.321122
N -3.643678 0.152381 -0.118655
N 2.197338 -3.686587 -3.095754
N 4.004702 5.714365 2.823154
C -4.155313 0.501291 -1.469615
C -4.589726 -0.628073 0.703575
C -3.032139 1.298648 0.593858
C -3.037917 0.730099 -2.510344
C -4.817104 -2.070746 0.167642
C -2.183075 0.843944 1.802357
C -3.612649 0.992425 -3.919343
C -2.443384 -2.647183 0.181433
C 0.189649 1.511313 1.734801
C -1.264468 -2.930226 -0.694090
C 1.147954 2.623257 2.030791
C 0.030336 -2.752364 -0.141893
C 2.520817 2.410077 1.740172
C -1.416975 -3.351656 -2.041171
C 0.718330 3.857723 2.583902
C 1.172012 -2.997704 -0.925794
C 3.465618 3.419678 1.997462
C -0.282969 -3.607545 -2.833249
C 1.653205 4.876407 2.846356
C 0.995280 -3.424936 -2.260067
C 3.012856 4.639076 2.547623
H -4.777133 -0.342317 -1.821670
H -4.824924 1.398614 -1.434467
H -4.177034 -0.704073 1.721190
H -5.599904 -0.150332 0.785236
H -3.791531 2.052973 0.918904
H -2.354947 1.808506 -0.112524
H -2.401644 1.586935 -2.214698
H -2.384993 -0.162615 -2.517191
H -5.080028 -2.736961 1.009560
H -5.604097 -2.120841 -0.600616
H -2.752915 0.804784 2.744212
H -1.713630 -0.131054 1.597770
H -2.803979 1.161537 -4.652478
H -4.266151 1.885431 -3.927193
H -4.212950 0.133002 -4.273276
H 0.123774 -2.406328 0.890905
H 2.824465 1.449158 1.313852
H -2.421849 -3.474707 -2.452795
H -0.341838 4.003924 2.803597
H 2.181510 -2.859043 -0.531787
H 4.528987 3.285724 1.784220
H -0.364489 -3.938626 -3.871445
H 1.356196 5.837981 3.272245


