%chk=000211454.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211454

0 1
O -2.799228 2.471202 -1.273482
O -0.217110 -0.796011 -1.297503
N 1.522696 1.709950 1.185236
N -1.822488 0.996209 0.150977
C -0.876931 2.050060 0.625067
C -0.709896 2.089608 2.160826
C 0.559291 1.881345 0.051077
C 0.805991 2.244309 2.393672
C 1.935255 0.282178 1.391590
C -1.628626 -0.368329 0.566955
C -2.710137 1.310888 -0.913226
C 2.705859 -0.266775 0.214501
C -3.502593 0.160072 -1.496569
C -0.797152 -1.270807 -0.148651
C -2.297520 -0.846560 1.702895
C 2.667192 -1.648471 -0.035195
C 3.480798 0.561104 -0.611908
C -4.575355 0.664542 -2.452591
C -0.616637 -2.592861 0.279500
C -2.119876 -2.165645 2.133179
C 3.380471 -2.189367 -1.108406
C 4.188027 0.016168 -1.685757
C -1.281423 -3.031764 1.427102
C 4.137152 -1.358887 -1.939853
H -1.304514 3.029705 0.268327
H -1.090940 1.177998 2.649119
H -1.278053 2.926647 2.597163
H 0.621759 1.060999 -0.693047
H 0.861082 2.807086 -0.484584
H 1.085508 3.317879 2.472300
H 1.137291 1.759085 3.328163
H 1.071738 -0.380086 1.630524
H 2.610360 0.260808 2.281676
H -3.962940 -0.449394 -0.691720
H -2.799729 -0.520021 -2.028971
H -2.962502 -0.177220 2.253173
H 2.097476 -2.304556 0.620100
H 3.525797 1.633700 -0.408852
H -5.097229 -0.164296 -2.941276
H -4.141367 1.304448 -3.235069
H -5.321361 1.278880 -1.931525
H 0.021828 -3.270373 -0.281406
H -2.642008 -2.516588 3.021628
H 3.354684 -3.261990 -1.290968
H 4.784265 0.665202 -2.325875
H -1.147275 -4.058967 1.767280
H 4.690847 -1.779761 -2.776017
H 0.533825 -1.377039 -1.602079


%chk=000211454-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211454

0 1
O -2.691923 2.498396 -1.321034
O -0.228344 -0.934769 -1.235805
N 1.551277 1.773985 1.123077
N -1.818108 0.927662 0.163795
C -0.892586 1.973457 0.701808
C -0.607871 1.904716 2.230078
C 0.545264 1.977832 0.035788
C 0.880816 2.359703 2.322650
C 1.963747 0.360485 1.330266
C -1.719384 -0.443631 0.599466
C -2.658420 1.300377 -0.902842
C 2.771545 -0.210179 0.167939
C -3.514008 0.191654 -1.526890
C -0.898194 -1.383179 -0.089390
C -2.443511 -0.885067 1.733141
C 2.777513 -1.610902 -0.066141
C 3.544402 0.623895 -0.676721
C -4.575553 0.750840 -2.491177
C -0.805796 -2.722805 0.362051
C -2.352748 -2.217898 2.192022
C 3.541083 -2.167509 -1.119405
C 4.303828 0.071295 -1.732928
C -1.526872 -3.135835 1.502785
C 4.304731 -1.324767 -1.961549
H -1.394008 2.922403 0.446397
H -0.708321 0.872966 2.610275
H -1.291171 2.550177 2.808477
H 0.630521 1.209415 -0.745849
H 0.715923 2.967392 -0.426165
H 0.943068 3.463380 2.255081
H 1.383238 2.043424 3.252752
H 1.106687 -0.327832 1.531759
H 2.595337 0.345930 2.241965
H -3.987171 -0.413847 -0.730867
H -2.830600 -0.494432 -2.066900
H -3.082648 -0.158669 2.247183
H 2.202274 -2.268294 0.600035
H 3.529423 1.703215 -0.492712
H -5.131863 -0.074758 -2.971153
H -4.103997 1.367124 -3.274481
H -5.295128 1.396734 -1.958746
H -0.185744 -3.439549 -0.190870
H -2.920924 -2.536049 3.071879
H 3.546739 -3.252450 -1.278205
H 4.894678 0.730274 -2.379471
H -1.450894 -4.174070 1.843752
H 4.893786 -1.750865 -2.781366
H 0.566209 -1.495075 -1.436256


