%chk=000206642.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206642

0 1
O 2.439273 0.220550 0.048645
O 2.116236 -2.000906 -0.556227
N 4.213719 -1.131180 -0.060218
C -2.498213 -0.659707 -0.041354
C -1.295200 0.276048 0.126227
C -2.649301 -0.949142 -1.547562
C -3.798464 -0.028231 0.490306
C -2.251488 -1.971995 0.727688
C 0.001884 -0.255276 0.002291
C -1.447433 1.649882 0.359901
C 1.089716 0.601244 0.130839
C -0.331286 2.487550 0.484406
C 0.960520 1.978309 0.373535
C 2.838310 -1.085666 -0.238631
H -3.494427 -1.617010 -1.741181
H -2.815200 -0.028843 -2.117390
H -1.752380 -1.428708 -1.956816
H -4.070077 0.877070 -0.062548
H -4.638947 -0.724703 0.396038
H -3.711630 0.234958 1.550028
H -3.116158 -2.639907 0.662410
H -1.389236 -2.522822 0.332007
H -2.057539 -1.781391 1.788635
H 0.147818 -1.321937 -0.195824
H -2.440160 2.087803 0.445152
H -0.474905 3.552190 0.669430
H 1.840700 2.606636 0.468034
H 4.739120 -0.287020 0.111009
H 4.723748 -1.928594 -0.412031


%chk=000206642-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206642

0 1
O 2.485229 0.218259 0.018403
O 2.176908 -2.045898 -0.681955
N 4.284798 -1.056289 -0.432600
C -2.518220 -0.652632 -0.043120
C -1.309515 0.289792 0.176797
C -2.509220 -1.167547 -1.514565
C -3.872294 0.056043 0.216519
C -2.408757 -1.868782 0.926289
C 0.002964 -0.226302 -0.015817
C -1.456002 1.645818 0.559937
C 1.119954 0.611530 0.175263
C -0.322443 2.472255 0.748090
C 0.975765 1.964296 0.558060
C 2.907735 -1.068652 -0.396832
H -3.361806 -1.852428 -1.682798
H -2.594432 -0.325632 -2.226101
H -1.580484 -1.717139 -1.748854
H -4.026569 0.909485 -0.469611
H -4.699667 -0.658369 0.052434
H -3.949331 0.424924 1.256239
H -3.259463 -2.558557 0.768689
H -1.476520 -2.437789 0.763512
H -2.423051 -1.534742 1.980183
H 0.160444 -1.263799 -0.313476
H -2.451408 2.070411 0.715559
H -0.453357 3.518800 1.044925
H 1.867141 2.582841 0.697410
H 4.801223 -0.215896 -0.185111
H 4.769377 -1.904797 -0.710668


