%chk=000269368.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269368

0 1
O -2.856529 -2.212526 -0.454581
N -1.931964 -0.183766 0.354423
N -4.086580 -0.229314 -0.503185
C -2.431148 1.229420 0.476704
C -1.587750 2.189294 -0.368553
C -0.116554 2.077428 0.047530
C -3.918642 1.154134 0.020416
C 0.366036 0.652570 0.081763
C -0.526020 -0.408473 0.180494
C -2.937798 -1.024105 -0.235009
C 1.776551 0.378621 0.026239
C -0.065553 -1.766871 0.179331
C 2.228494 -0.967265 0.040068
C 1.273155 -2.031726 0.109098
C 2.757124 1.421072 -0.043640
C 3.630071 -1.245800 -0.015765
C 4.097459 1.128356 -0.095227
C 4.543658 -0.223654 -0.081142
H -2.364684 1.507552 1.559144
H -1.945099 3.228165 -0.249455
H -1.692458 1.947528 -1.446699
H 0.033874 2.531972 1.050440
H 0.503373 2.674607 -0.654985
H -4.607288 1.376476 0.859122
H -4.145141 1.873113 -0.795961
H -5.006661 -0.654763 -0.438943
H -0.802868 -2.576930 0.227885
H 1.634377 -3.060451 0.106198
H 2.425160 2.458064 -0.056056
H 3.955274 -2.285480 -0.004955
H 4.839463 1.923644 -0.147695
H 5.611768 -0.426690 -0.123302


%chk=000269368-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000269368

0 1
O -2.967898 -2.312444 -0.190599
N -1.937765 -0.145820 0.073789
N -4.183436 -0.296715 0.063624
C -2.425083 1.227759 0.371396
C -1.600887 2.250921 -0.417059
C -0.112418 2.120052 -0.026503
C -3.937598 1.150756 0.015060
C 0.369488 0.669415 0.002153
C -0.544905 -0.411354 0.012980
C -3.014313 -1.060756 -0.036705
C 1.784731 0.388043 0.012022
C -0.077914 -1.772167 -0.023238
C 2.251504 -0.984435 -0.013987
C 1.284057 -2.040940 -0.042784
C 2.776271 1.429422 0.050346
C 3.656618 -1.259338 -0.009404
C 4.142630 1.132344 0.057350
C 4.593273 -0.223541 0.024707
H -2.301089 1.417718 1.458748
H -1.965082 3.274968 -0.212427
H -1.730764 2.054665 -1.498386
H 0.056919 2.591457 0.964224
H 0.494512 2.698968 -0.747350
H -4.553252 1.702328 0.745878
H -4.126183 1.570620 -0.995603
H -5.085885 -0.736833 -0.099755
H -0.817331 -2.575662 -0.036117
H 1.632243 -3.080217 -0.070305
H 2.463341 2.477840 0.085037
H 3.986111 -2.305238 -0.032006
H 4.876793 1.945487 0.089972
H 5.666412 -0.443099 0.028644


