%chk=000200502.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200502

0 1
O -1.131465 -0.220516 -1.013620
O -0.264387 -1.621807 0.565610
N 2.157790 -0.143159 -0.458813
N 4.868622 0.259619 0.480228
C 2.828411 -1.151220 0.428745
C 3.177306 0.552516 -1.312304
C 3.845142 -0.430678 1.333950
C 4.190020 1.270306 -0.396941
C 1.111785 -0.789846 -1.307118
C 5.900103 0.920279 1.334131
C -0.115959 -0.961986 -0.428336
C -2.399692 -0.160119 -0.399073
C -2.567935 0.581701 0.785257
C -3.465213 -0.773710 -1.080143
C -3.871049 0.713659 1.286656
C -4.753686 -0.615277 -0.547262
C -1.398803 1.185896 1.481438
C -3.238534 -1.567717 -2.321463
C -4.949278 0.120616 0.623826
H 3.339259 -1.956540 -0.142159
H 2.044601 -1.633238 1.059399
H 2.655807 1.305075 -1.941538
H 3.716882 -0.142300 -1.992486
H 3.311232 0.263182 2.019410
H 4.367248 -1.181705 1.964577
H 4.963348 1.762105 -1.024620
H 3.672842 2.068530 0.179223
H 0.862211 -0.131382 -2.173904
H 1.393415 -1.781920 -1.725939
H 6.413112 0.150751 1.933664
H 5.515867 1.691753 2.017422
H 6.662377 1.379788 0.684523
H -4.041594 1.279215 2.200468
H -5.603061 -1.073820 -1.049080
H -0.695161 1.647183 0.770432
H -1.684229 1.953676 2.209501
H -0.831791 0.407319 2.022769
H -2.261500 -1.345845 -2.776134
H -3.262588 -2.646062 -2.104436
H -4.004479 -1.367194 -3.082457
H -5.955175 0.232269 1.027295


%chk=000200502-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200502

0 1
O -1.014448 -0.086170 -1.191394
O -0.383038 -2.177791 -0.337508
N 2.127946 -0.278388 -0.700650
N 4.582428 0.291156 0.706569
C 2.756032 -1.300323 0.175781
C 3.147386 0.626342 -1.287277
C 3.561270 -0.612274 1.288273
C 3.945864 1.307005 -0.163337
C 1.203333 -0.857385 -1.706202
C 5.454734 0.892777 1.732582
C -0.121141 -1.161294 -1.012282
C -2.245912 -0.062374 -0.437632
C -2.283982 0.804996 0.680410
C -3.349214 -0.824921 -0.885273
C -3.511933 0.899079 1.380678
C -4.558208 -0.694830 -0.156795
C -1.059347 1.596840 1.094409
C -3.235901 -1.743622 -2.084905
C -4.640326 0.156568 0.966771
H 3.440117 -1.963088 -0.410562
H 1.964952 -1.929132 0.619984
H 2.634314 1.397134 -1.891374
H 3.858236 0.072814 -1.949845
H 2.852006 -0.057008 1.955142
H 4.072931 -1.380236 1.897982
H 4.735985 1.941730 -0.606828
H 3.250671 1.969519 0.414927
H 1.027933 -0.115472 -2.501959
H 1.594667 -1.795924 -2.163511
H 5.955099 0.094343 2.309574
H 4.904458 1.548108 2.455004
H 6.236885 1.502859 1.245745
H -3.577128 1.558837 2.253579
H -5.435163 -1.269354 -0.476758
H -0.770917 2.320631 0.309743
H -1.251014 2.152661 2.027794
H -0.180868 0.943389 1.246849
H -2.746769 -1.237002 -2.936614
H -2.626537 -2.632984 -1.837733
H -4.230650 -2.090580 -2.411078
H -5.582952 0.242762 1.518419


