%chk=000249135.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249135

0 1
O 0.922833 -0.091222 2.635357
N -0.461911 -1.331539 0.450624
N -1.574491 -1.910974 -0.106845
N -2.638577 -3.870336 -0.853802
N -0.243465 -3.829054 -0.928941
C 0.783834 0.520999 1.351253
C 2.045964 0.379086 0.522135
C -0.449742 -0.043186 0.632334
C -1.475014 0.957994 0.245573
C 3.236154 -0.046584 1.125752
C 2.034729 0.714754 -0.839146
C -1.805483 1.141296 -1.104967
C -2.112976 1.719593 1.236402
C 4.406354 -0.149404 0.368485
C 3.207350 0.612159 -1.591964
C 4.393687 0.177940 -0.990873
C -2.759649 2.098210 -1.461985
C -3.070055 2.669809 0.871936
C -3.390411 2.863762 -0.476073
C -1.438922 -3.150670 -0.581214
H 0.629472 1.597360 1.625124
H 3.244482 -0.285880 2.190665
H 1.113882 1.054598 -1.311901
H -1.329778 0.528295 -1.869145
H -1.869851 1.559861 2.287205
H 5.329436 -0.481100 0.840535
H 3.196730 0.871820 -2.649038
H 0.933885 -1.074063 2.552630
H 5.305230 0.098523 -1.579525
H -3.015066 2.243610 -2.509971
H -3.568433 3.258730 1.640143
H -4.133646 3.607486 -0.756819
H -3.489873 -3.326966 -0.704073
H -2.664689 -4.349529 -1.747814
H -0.259127 -4.841051 -0.898886
H 0.606139 -3.446629 -0.517269


%chk=000249135-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249135

0 1
O 0.880212 -1.191199 2.321128
N -0.691922 -1.569810 0.270578
N -1.758041 -2.065968 -0.499391
N -2.595620 -4.027203 -1.440151
N -0.382612 -4.043944 -0.593232
C 0.656562 -0.026222 1.452475
C 1.945412 0.305412 0.672707
C -0.577663 -0.278537 0.549267
C -1.443670 0.857995 0.155530
C 3.187287 0.161161 1.344732
C 1.943725 0.758712 -0.669989
C -2.718715 0.674398 -0.465148
C -1.018831 2.198521 0.418285
C 4.399828 0.469343 0.690642
C 3.158669 1.064466 -1.327153
C 4.390425 0.924793 -0.649483
C -3.529281 1.781705 -0.788308
C -1.831169 3.300123 0.084886
C -3.095247 3.099897 -0.517101
C -1.554864 -3.361110 -0.822159
H 0.429143 0.803054 2.147595
H 3.184911 -0.216585 2.372310
H 0.998116 0.863809 -1.212527
H -3.041758 -0.345171 -0.681940
H -0.039757 2.389743 0.868980
H 5.350998 0.351860 1.222936
H 3.140615 1.409458 -2.367519
H 0.494891 -1.952536 1.792485
H 5.331261 1.163253 -1.158854
H -4.506160 1.614766 -1.257102
H -1.477019 4.315911 0.293420
H -3.728312 3.957349 -0.772044
H -3.458471 -3.503496 -1.568354
H -2.448644 -4.881898 -1.969543
H -0.307631 -5.054324 -0.664564
H 0.352334 -3.500028 -0.137492


