%chk=000186118.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186118

0 1
O -4.319077 1.904761 0.349167
O 2.193623 2.636990 -0.522071
N -1.186969 -0.859029 0.533975
N 1.596419 0.438570 -0.448144
C -0.431614 -0.355492 -1.802203
C -1.657072 -0.525709 -0.855616
C 0.857845 -1.957543 -0.425153
C 0.354629 -1.673347 -1.847397
C -0.336139 -2.094383 0.548242
C -2.494960 0.768005 -0.822769
C 0.500238 0.800943 -1.397982
C -2.338616 -1.036508 1.482564
C 1.774177 -0.841249 0.043015
C -3.671774 0.631684 0.152372
C -3.175003 0.245256 1.549070
C 2.793389 -1.105229 0.942576
C 2.442516 1.551654 -0.022647
C 3.640924 -0.057346 1.386928
C 3.477074 1.216640 0.923943
H -0.827230 -0.124350 -2.822150
H -2.296001 -1.348850 -1.275586
H 1.429327 -2.919563 -0.418364
H 1.202197 -1.599972 -2.555451
H -0.276188 -2.503010 -2.213440
H -0.901658 -3.018117 0.298484
H 0.050287 -2.215328 1.586473
H -1.853367 1.619084 -0.494097
H -2.846807 1.020144 -1.837015
H 0.981433 1.242666 -2.303040
H -0.091604 1.627917 -0.923061
H -1.912009 -1.243420 2.490214
H -2.985619 -1.901502 1.219094
H -4.440981 -0.074664 -0.229492
H -4.027803 0.124741 2.242267
H -2.570652 1.082124 1.962605
H 2.947061 -2.108537 1.322016
H -4.512999 2.338088 -0.499976
H 4.428396 -0.291704 2.106373
H 4.105008 2.045184 1.245276


%chk=000186118-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000186118

0 1
O -4.458086 1.894614 0.330274
O 2.222925 2.695181 -0.529320
N -1.193520 -0.859864 0.533328
N 1.618503 0.423006 -0.429188
C -0.414810 -0.336047 -1.790610
C -1.638020 -0.476151 -0.833743
C 0.855684 -1.960585 -0.424417
C 0.345346 -1.678318 -1.853360
C -0.365052 -2.086221 0.528867
C -2.501798 0.804689 -0.783555
C 0.571057 0.793209 -1.427822
C -2.321597 -1.002600 1.492149
C 1.803007 -0.866154 0.043416
C -3.694054 0.644624 0.180613
C -3.177190 0.273128 1.574280
C 2.829583 -1.132251 0.949372
C 2.448919 1.544420 -0.026260
C 3.671770 -0.070563 1.401792
C 3.485946 1.224757 0.935209
H -0.826029 -0.089640 -2.789236
H -2.277263 -1.298139 -1.269334
H 1.404715 -2.918964 -0.388591
H 1.183675 -1.625493 -2.572941
H -0.330530 -2.490986 -2.181161
H -0.958965 -2.983326 0.204076
H -0.016955 -2.273165 1.561474
H -1.900912 1.662280 -0.429322
H -2.856449 1.035054 -1.809507
H 1.105054 1.138415 -2.333548
H 0.058721 1.686211 -1.034549
H -1.896929 -1.234102 2.486500
H -2.977258 -1.868188 1.204966
H -4.362541 -0.165194 -0.195376
H -4.027106 0.115265 2.262553
H -2.573077 1.113129 1.962411
H 2.971810 -2.157342 1.301718
H -4.773862 2.189501 -0.561713
H 4.472349 -0.283611 2.119418
H 4.113341 2.059023 1.260141


