%chk=000206842.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206842

0 1
O -2.162124 3.993499 0.194512
O 0.436168 -3.935560 -0.972670
O -1.573745 -4.454219 -0.364300
N -2.045083 1.736307 0.331470
N 0.822413 2.327251 -0.682874
N -0.679189 -3.648515 -0.567943
C -1.517790 0.453437 0.098543
C -3.784939 0.120931 0.844239
C -3.420009 1.622411 0.946592
C -2.528773 -0.540461 0.351165
C -0.215135 0.092689 -0.268970
C -2.267541 -1.870415 0.141644
C -1.571958 2.993095 -0.144544
C 0.889371 1.079986 -0.350242
C 0.037234 -1.277355 -0.489780
C -0.967752 -2.228145 -0.308247
C -0.404495 2.984440 -1.121673
C 2.241799 0.570270 0.031937
C 2.435728 0.000319 1.299665
C 3.311050 0.672695 -0.868659
C 3.698762 -0.476569 1.656977
C 4.571014 0.188034 -0.504436
C 4.765276 -0.387054 0.754988
H -4.629623 -0.047695 0.148865
H -4.101182 -0.284665 1.824080
H -4.132915 2.278364 0.406490
H -3.373191 1.973974 1.998825
H -3.017054 -2.651464 0.307761
H 1.040554 -1.603293 -0.804956
H -0.756924 2.591170 -2.107135
H -0.117753 4.059228 -1.305369
H 1.606870 -0.064131 2.003405
H 3.161374 1.138308 -1.842974
H 3.853669 -0.918531 2.640450
H 5.402922 0.263625 -1.203659
H 5.747971 -0.763763 1.036123


%chk=000206842-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206842

0 1
O -2.100284 4.042576 -0.095084
O 0.261313 -4.092712 -0.942000
O -1.862215 -4.524670 -0.222704
N -1.977815 1.760292 0.335872
N 0.806063 2.223423 -0.856499
N -0.889521 -3.714091 -0.491081
C -1.531252 0.446472 0.091050
C -3.800784 0.285947 0.883498
C -3.256359 1.727385 1.119318
C -2.575993 -0.478096 0.396449
C -0.229478 0.020326 -0.305493
C -2.382282 -1.845631 0.212177
C -1.562273 2.930258 -0.333004
C 0.913393 0.982401 -0.419912
C -0.052230 -1.376062 -0.497135
C -1.112470 -2.271095 -0.263854
C -0.483134 2.700199 -1.403967
C 2.277971 0.540581 0.014723
C 2.469943 -0.413584 1.050948
C 3.418690 1.129668 -0.595704
C 3.772228 -0.776028 1.458924
C 4.717433 0.762426 -0.191661
C 4.899874 -0.194215 0.836371
H -4.594879 0.279203 0.113350
H -4.228804 -0.144750 1.803741
H -3.918291 2.530867 0.762320
H -3.032435 1.911520 2.185137
H -3.158834 -2.588349 0.412198
H 0.912452 -1.774375 -0.821787
H -0.899611 1.986735 -2.150794
H -0.314521 3.671305 -1.891779
H 1.606173 -0.856355 1.558320
H 3.259530 1.877908 -1.378022
H 3.905435 -1.507681 2.263153
H 5.587918 1.217642 -0.676582
H 5.910048 -0.481243 1.148814


