%chk=000206845.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206845

0 1
O -3.067456 2.866650 0.231220
N -2.436386 0.694663 0.031710
N 0.251744 1.803255 0.131792
C 0.722728 0.625316 -0.665463
C -0.213019 -0.554455 -0.468466
C -1.579262 -0.436567 -0.159330
C -2.396770 -1.605519 0.025069
C -0.817163 2.566756 -0.545085
C 2.142011 0.313185 -0.214077
C -2.174353 2.090483 -0.042387
C 0.288576 -1.850783 -0.634576
C -3.745349 0.198233 0.374191
C -3.739242 -1.166505 0.364288
C -1.857783 -2.884325 -0.134611
C -0.513017 -2.994144 -0.473699
C 3.195963 0.369063 -1.136102
C 2.401017 -0.015491 1.124837
C 4.502343 0.097079 -0.718486
C 3.708276 -0.283837 1.537382
C 4.760298 -0.228007 0.616806
H 0.725621 0.848061 -1.772154
H 1.035594 2.419462 0.373318
H -0.811780 2.500808 -1.658628
H -0.736093 3.654398 -0.298723
H 1.341621 -1.990129 -0.887841
H -4.539670 0.901931 0.581931
H -4.559200 -1.828272 0.567101
H -2.480936 -3.764478 0.004248
H -0.065565 -3.977222 -0.611995
H 3.005141 0.618666 -2.178124
H 1.573829 -0.062014 1.836748
H 5.320143 0.138642 -1.436165
H 3.907126 -0.538849 2.577489
H 5.778413 -0.438654 0.939683


%chk=000206845-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000206845

0 1
O -3.146814 2.904812 0.200774
N -2.430019 0.692599 0.127728
N 0.276374 1.830509 0.001923
C 0.749290 0.624243 -0.710451
C -0.224349 -0.554793 -0.524891
C -1.587946 -0.437511 -0.150114
C -2.408278 -1.606866 0.049669
C -0.864312 2.539551 -0.580073
C 2.165906 0.308326 -0.224625
C -2.220257 2.084959 -0.041980
C 0.252764 -1.868913 -0.763571
C -3.713544 0.210975 0.514986
C -3.726545 -1.164524 0.475779
C -1.891924 -2.901694 -0.180998
C -0.555112 -3.021679 -0.604848
C 3.261449 0.346111 -1.119603
C 2.400454 0.010064 1.142734
C 4.574614 0.085909 -0.662209
C 3.710241 -0.244000 1.602490
C 4.801719 -0.208876 0.701153
H 0.815527 0.823235 -1.812175
H 1.044078 2.445654 0.283721
H -0.899341 2.448081 -1.694226
H -0.803988 3.615624 -0.348637
H 1.301838 -1.991573 -1.054430
H -4.486371 0.935215 0.759858
H -4.575386 -1.804184 0.712152
H -2.521219 -3.785170 -0.030321
H -0.123955 -4.009851 -0.797631
H 3.086926 0.578645 -2.177814
H 1.551743 -0.026910 1.834326
H 5.414268 0.114341 -1.365576
H 3.881940 -0.473907 2.660089
H 5.817630 -0.411002 1.058691


