%chk=000267105.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267105

0 1
O 0.036010 -5.059376 0.426307
O 3.874495 2.841452 -2.260863
O -4.206992 2.891989 -1.347919
O 7.524711 1.426611 0.198174
O -7.236122 1.516901 1.862389
N -0.029532 -1.009535 -0.385611
N 2.473174 0.243425 -1.345584
N -2.667414 0.277029 -0.762544
N 3.541905 -1.248387 0.028785
N -3.420056 -1.202610 0.818840
N 5.690190 0.038545 0.209458
N -5.457367 0.110921 1.473039
N 5.701210 2.138155 -1.041196
N -5.716528 2.216384 0.259570
C 1.166882 -1.849980 -0.712952
C -1.279666 -1.833910 -0.435361
C 1.319082 -3.066364 0.211055
C -1.236752 -3.049599 0.501017
C 0.037124 -3.854186 0.366468
C 2.384705 -0.962089 -0.657722
C -2.442536 -0.930382 -0.109983
C 3.747206 0.765783 -1.084176
C -3.843460 0.815605 -0.222916
C 4.391080 -0.177594 -0.235525
C -4.293051 -0.120638 0.749742
C 4.361994 1.992863 -1.544348
C -4.528606 2.052247 -0.533941
C 6.390894 1.223690 -0.188748
C -6.213433 1.306181 1.241000
C 6.356312 -0.950264 1.091439
C -5.924019 -0.872497 2.480252
C 6.472350 3.346027 -1.449556
C -6.518242 3.457513 0.066637
H 1.047239 -2.213033 -1.775778
H -1.405901 -2.196900 -1.497447
H 1.684123 -2.764127 1.220142
H 2.136840 -3.728913 -0.157079
H -2.124703 -3.700958 0.326370
H -1.362544 -2.744173 1.565796
H 0.079521 -0.589422 0.551182
H 1.764868 0.705397 -1.893925
H -2.094170 0.730472 -1.456498
H 7.390419 -0.623315 1.316529
H 6.393487 -1.938487 0.599048
H 5.800576 -1.052652 2.040362
H -6.879872 -0.535099 2.926852
H -5.174473 -0.982660 3.283866
H -6.079188 -1.859307 2.008474
H 5.780511 4.128664 -1.814405
H 7.179333 3.095070 -2.258697
H 7.047828 3.744254 -0.594559
H -6.260508 3.925332 -0.902377
H -6.308208 4.179765 0.873957
H -7.598425 3.225484 0.078462


%chk=000267105-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267105

0 1
O 0.062781 -5.062646 0.681897
O 3.612951 3.042041 -1.921642
O -3.850680 3.114216 -1.021105
O 7.702034 1.325880 -0.295888
O -7.501545 1.437474 1.462845
N -0.004443 -0.981820 -0.157356
N 2.406534 0.319265 -1.043753
N -2.528499 0.359122 -0.467216
N 3.665712 -1.302634 -0.064577
N -3.565921 -1.256151 0.753097
N 5.813069 -0.056690 -0.125129
N -5.649701 0.022280 1.186849
N 5.662553 2.157175 -1.099721
N -5.678668 2.249469 0.232086
C 1.195684 -1.824880 -0.443578
C -1.249399 -1.808416 -0.166348
C 1.371058 -3.006193 0.560636
C -1.211964 -2.988486 0.852867
C 0.072810 -3.804548 0.695432
C 2.421188 -0.951910 -0.493871
C -2.442365 -0.918242 0.060700
C 3.706836 0.822557 -0.969656
C -3.770836 0.880921 -0.100462
C 4.456646 -0.198531 -0.366869
C -4.385145 -0.136845 0.644754
C 4.252859 2.089889 -1.380770
C -4.370756 2.163437 -0.362271
C 6.467798 1.147314 -0.492750
C -6.346632 1.242612 0.991373
C 6.584666 -1.144382 0.507683
C -6.280424 -1.063436 1.962847
C 6.379909 3.399931 -1.469830
C -6.435696 3.510531 0.051424
H 1.028861 -2.260035 -1.452185
H -1.319705 -2.243688 -1.186130
H 1.647980 -2.587822 1.549385
H 2.189128 -3.674563 0.248255
H -2.088201 -3.644969 0.731727
H -1.255139 -2.568824 1.878182
H 0.102193 -0.506394 0.755605
H 1.587364 0.804493 -1.410855
H -1.802742 0.835415 -1.003563
H 7.627887 -0.806950 0.589648
H 6.527328 -2.057405 -0.108152
H 6.177514 -1.365905 1.508436
H -7.269742 -0.708670 2.285667
H -5.660784 -1.311821 2.840724
H -6.385303 -1.965181 1.336706
H 5.643784 4.081290 -1.920717
H 7.185934 3.171586 -2.185872
H 6.832202 3.856090 -0.574324
H -5.806656 4.188286 -0.543868
H -6.665138 3.957031 1.032535
H -7.386877 3.309034 -0.467401


