%chk=000206984.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206984

0 1
O 0.824852 0.345003 0.060997
O -5.302713 -0.646170 -0.170766
O 0.787332 -0.069338 -2.186999
O 2.447749 3.574053 1.766197
O 0.660773 2.476590 1.252285
N 2.436760 -1.870231 -0.712438
N 1.872944 2.586376 1.332877
C 3.019062 -0.746558 -0.144585
C 4.412817 -0.654643 0.112678
C 2.167607 0.363154 0.230244
C 2.708651 1.463592 0.893083
C 4.942329 0.504775 0.763991
C 4.115940 1.522615 1.152022
C -1.255800 -0.160207 -0.849801
C -6.000205 -0.043351 0.971887
C -7.440010 -0.508710 0.764054
C 5.231986 -1.760027 -0.286556
C -3.965178 -0.428303 -0.310219
C 0.163923 -0.023357 -1.169371
C -2.071730 -0.918270 -1.720284
C -1.810044 0.461078 0.283954
C -3.422609 -1.059730 -1.457102
C -3.169387 0.333486 0.561148
C 4.652419 -2.857122 -0.869814
C 3.228585 -2.878190 -1.058627
C -8.345840 0.023257 1.867082
H 6.015190 0.556042 0.949118
H 4.500813 2.414337 1.663028
H -5.888510 1.051768 0.911057
H -5.550944 -0.433176 1.899964
H -7.798874 -0.176436 -0.232318
H -7.472472 -1.617537 0.730452
H 6.308120 -1.707152 -0.117182
H -1.626033 -1.390098 -2.600745
H -1.160835 1.056766 0.944190
H -4.077669 -1.638117 -2.105649
H -3.587184 0.822271 1.435514
H 5.242207 -3.714413 -1.191295
H 2.748755 -3.758305 -1.507222
H -8.362368 1.119631 1.891507
H -9.380642 -0.311234 1.717825
H -8.034165 -0.326319 2.858718


%chk=000206984-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206984

0 1
O 0.884682 0.622203 0.232687
O -5.382245 -0.500613 -0.421800
O 0.851783 0.187209 -2.085368
O 3.147296 4.056598 0.759472
O 1.201023 3.052764 1.397637
N 2.169217 -1.792348 -0.210655
N 2.409552 3.008929 0.955823
C 2.948546 -0.684716 0.075750
C 4.389465 -0.739855 0.165850
C 2.268908 0.568863 0.314158
C 3.031964 1.694878 0.674837
C 5.124950 0.440019 0.511024
C 4.458043 1.631997 0.763396
C -1.217337 0.065911 -0.788073
C -6.076980 -0.328610 0.873818
C -7.560687 -0.607317 0.626542
C 5.014938 -2.002865 -0.093224
C -4.004557 -0.297391 -0.469057
C 0.226001 0.247827 -1.012562
C -2.029067 -0.290705 -1.903298
C -1.820250 0.241945 0.483603
C -3.407961 -0.473755 -1.747660
C -3.205965 0.063362 0.649774
C 4.224515 -3.110720 -0.401765
C 2.800121 -2.958030 -0.437854
C -8.387063 -0.470058 1.924170
H 6.217203 0.393970 0.577823
H 4.992498 2.549809 1.020725
H -5.920503 0.706762 1.240559
H -5.655130 -1.038958 1.614601
H -7.933205 0.095313 -0.141654
H -7.667672 -1.626093 0.210079
H 6.106595 -2.082512 -0.043904
H -1.554360 -0.419749 -2.881327
H -1.195517 0.528751 1.333319
H -4.048612 -0.749569 -2.590155
H -3.650876 0.209575 1.637645
H 4.669234 -4.089000 -0.607399
H 2.159022 -3.819460 -0.657499
H -8.309245 0.548934 2.347691
H -9.454928 -0.670271 1.728277
H -8.047793 -1.185225 2.696893


