%chk=000261449.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261449

0 1
O -5.414020 -0.532097 0.195557
O 6.252760 0.115034 0.500590
O -4.940628 1.562486 -0.513830
O 4.644308 -0.318712 -1.040015
N 0.810822 -0.918073 1.223510
N 1.825177 -0.028409 1.055356
N 2.967793 -0.455720 1.394795
C -3.159861 0.121656 0.264504
C -0.514287 -0.524019 0.880104
C -2.846984 -1.155823 0.757029
C -2.140103 1.073002 0.078686
C -1.531508 -1.487290 1.067065
C -0.819995 0.759045 0.383247
C -4.544970 0.505559 -0.073076
C -6.830038 -0.329848 -0.113194
C 7.317304 -0.237678 -0.441645
C -7.059651 -0.495965 -1.600735
C 4.071375 0.510259 1.215091
C 4.951085 0.037100 0.067961
C 7.527938 0.889481 -1.429630
H -3.647858 -1.889801 0.895172
H -2.397040 2.064838 -0.309482
H -1.300478 -2.479935 1.446965
H -0.030409 1.496916 0.234184
H 0.978541 -1.877372 1.560079
H -7.131441 0.667320 0.254884
H -7.289378 -1.131322 0.493252
H 7.047376 -1.190274 -0.931338
H 8.166302 -0.377119 0.252705
H -8.128200 -0.502369 -1.844463
H -6.596717 0.327130 -2.166753
H -6.622968 -1.430484 -1.975270
H 3.765470 1.566190 1.015837
H 4.652830 0.515270 2.174616
H 7.659106 1.854017 -0.922904
H 6.667164 0.991498 -2.108155
H 8.414682 0.716511 -2.051500


%chk=000261449-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000261449

0 1
O -5.477037 -0.536123 0.150003
O 6.368164 0.239485 0.533843
O -4.905787 1.633083 -0.507584
O 4.716153 -0.732144 -0.807945
N 0.822119 -0.910314 1.264733
N 1.868255 -0.037319 1.121118
N 2.992688 -0.568231 1.515113
C -3.174097 0.108045 0.280819
C -0.493255 -0.545166 0.927513
C -2.852449 -1.184148 0.772775
C -2.136039 1.064357 0.115331
C -1.524736 -1.510413 1.094434
C -0.805664 0.751465 0.432400
C -4.562343 0.503957 -0.070530
C -6.900582 -0.245567 -0.194083
C 7.409592 -0.096594 -0.489984
C -7.169303 -0.522166 -1.676393
C 4.121188 0.372301 1.334101
C 5.056146 -0.122486 0.226591
C 7.498156 0.998463 -1.555801
H -3.650220 -1.920742 0.898669
H -2.399773 2.055918 -0.266987
H -1.282142 -2.510506 1.473707
H -0.005879 1.484080 0.304067
H 1.036091 -1.853864 1.622311
H -7.116341 0.806810 0.061343
H -7.470208 -0.922249 0.463293
H 7.155964 -1.074460 -0.935562
H 8.334416 -0.175718 0.103042
H -8.244962 -0.383006 -1.893116
H -6.597233 0.173246 -2.313000
H -6.894905 -1.558208 -1.940477
H 3.776902 1.391555 1.060173
H 4.694201 0.428890 2.274586
H 7.691563 1.982896 -1.095854
H 6.566224 1.052823 -2.143212
H 8.328632 0.773051 -2.250239


