%chk=000213071.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213071

0 1
O -0.270932 -0.593995 -0.847054
O 1.396196 2.287254 -0.075615
O -1.632030 1.109082 -1.569500
O 3.343239 3.250637 0.682507
N -2.364365 -0.574275 -0.081964
N 1.932585 4.339466 -0.824605
C 2.062785 -0.008625 -0.570972
C 3.314792 0.419928 -1.384078
C 0.866499 -0.010169 -1.557352
C 1.738356 1.012185 0.544715
C 2.300813 -1.392395 0.024654
C 4.580557 0.549311 -0.546021
C 2.730406 -1.553261 1.351143
C 2.134424 -2.536505 -0.774156
C 2.968846 -2.829063 1.871257
C 2.374118 -3.809875 -0.253001
C 2.789943 -3.961719 1.073274
C -1.465613 0.110180 -0.905651
C 2.335581 3.302194 0.008912
C -3.737782 -0.214311 0.104418
C -4.506815 -1.035863 0.954230
C -4.308569 0.907372 -0.519953
C -5.848615 -0.719737 1.170014
C -5.652975 1.201478 -0.288019
C -6.426333 0.394942 0.553229
H 3.107552 1.389454 -1.882613
H 3.487120 -0.315604 -2.195322
H 1.016832 -0.674912 -2.424148
H 0.617356 1.016937 -1.896341
H 2.573601 1.150286 1.256674
H 0.803164 0.751803 1.075726
H 4.803273 -0.368128 0.011026
H 5.448722 0.765193 -1.179880
H 4.507354 1.374761 0.180492
H 2.896493 -0.688448 1.992435
H 1.808127 -2.439386 -1.808929
H 3.298932 -2.937140 2.903483
H 2.236873 -4.686885 -0.883769
H 2.975541 -4.953609 1.479138
H -2.021826 -1.413902 0.397266
H 1.002590 4.326610 -1.223206
H 2.346022 5.251406 -0.685763
H -4.070030 -1.904838 1.439103
H -3.710262 1.543583 -1.179732
H -6.449449 -1.349816 1.825888
H -6.100955 2.070740 -0.770459
H -7.472841 0.633159 0.727118


%chk=000213071-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213071

0 1
O -0.323421 -0.380162 -0.483267
O 1.626704 2.355659 -0.010982
O -1.798786 0.910891 -1.802316
O 3.594783 3.333674 0.869318
N -2.503607 -0.361761 0.074727
N 2.010267 4.562946 -0.352050
C 2.114317 -0.014160 -0.546285
C 3.264203 0.384278 -1.538398
C 0.803559 -0.015613 -1.374519
C 1.979680 1.042892 0.579488
C 2.382685 -1.416619 0.048745
C 4.678442 0.426661 -0.920632
C 2.580289 -1.641654 1.435367
C 2.465514 -2.538572 -0.819569
C 2.845265 -2.937571 1.936290
C 2.728919 -3.833216 -0.325980
C 2.920475 -4.041190 1.059849
C -1.586667 0.139555 -0.834321
C 2.517332 3.423044 0.229045
C -3.902492 -0.113622 0.132949
C -4.636388 -0.759753 1.164115
C -4.574056 0.737681 -0.784273
C -6.026502 -0.557856 1.278501
C -5.966679 0.928560 -0.654452
C -6.702679 0.288871 0.369216
H 3.019969 1.374607 -1.970563
H 3.257964 -0.334353 -2.381723
H 0.843820 -0.759945 -2.189851
H 0.610165 0.982024 -1.803327
H 2.914205 1.159941 1.153659
H 1.144660 0.786970 1.252067
H 4.942999 -0.539445 -0.454799
H 5.426304 0.638858 -1.706351
H 4.767265 1.220519 -0.158414
H 2.535340 -0.812011 2.147333
H 2.324602 -2.406211 -1.899085
H 2.995390 -3.080853 3.012546
H 2.786242 -4.678394 -1.021280
H 3.126805 -5.045113 1.447078
H -2.107505 -0.993403 0.774691
H 1.113657 4.540066 -0.832439
H 2.534801 5.428687 -0.267713
H -4.118719 -1.418920 1.872822
H -4.007158 1.230206 -1.576905
H -6.580180 -1.062593 2.077924
H -6.479692 1.586128 -1.365369
H -7.782793 0.445775 0.457729


