%chk=000259167.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259167

0 1
O -0.072848 -0.157484 -0.017559
O 4.382238 2.242357 0.945258
N 3.854662 -0.092946 0.836169
N -2.420127 -0.603759 -0.211246
C 0.855892 2.032995 -0.198254
C 2.126137 1.599894 0.294985
C 2.391856 0.159063 0.626947
C -0.283259 1.165734 -0.364024
C -1.509451 1.614011 -0.818806
C -2.691090 0.689770 -0.918996
C 0.671919 3.397531 -0.552547
C 3.130075 2.542191 0.443539
C -1.054267 -1.106053 -0.517014
C 4.483282 0.978534 1.654462
C -1.652973 2.986217 -1.171697
C 4.106026 -1.442168 1.438770
C -0.594710 3.848314 -1.046530
C -3.455312 -1.642293 -0.521631
C 1.760614 4.319186 -0.414719
C 2.971308 3.911649 0.078701
C 3.660188 -2.535893 0.495690
C -4.813812 -1.202878 -0.026535
C 2.903203 -3.611097 0.982384
C 4.027962 -2.498813 -0.858232
C -4.966618 -0.707872 1.277593
C -5.932811 -1.320221 -0.863121
C 2.523982 -4.644694 0.120169
C 3.642324 -3.531456 -1.715251
C -6.230605 -0.334514 1.739015
C -7.196585 -0.948615 -0.393884
C 2.892141 -4.607590 -1.227714
C -7.348042 -0.456015 0.905521
H 1.754175 -0.152068 1.487046
H 2.084609 -0.483843 -0.239627
H -3.570658 1.149032 -0.402630
H -2.975650 0.555571 -1.986958
H -0.820923 -2.005397 0.089942
H -0.832083 -1.258934 -1.592179
H 4.034654 1.137193 2.655562
H 5.582772 0.838490 1.705675
H -2.617740 3.335493 -1.536707
H 3.627123 -1.562931 2.436702
H 5.206705 -1.547522 1.598107
H -0.700108 4.897496 -1.316752
H -3.172900 -2.578004 0.019790
H -3.494247 -1.901453 -1.603638
H 1.603132 5.357398 -0.707044
H 3.816391 4.586702 0.200854
H 2.608606 -3.647725 2.028860
H 4.604377 -1.650793 -1.234651
H -4.089278 -0.605462 1.919645
H -5.825835 -1.700057 -1.876653
H 1.941595 -5.480941 0.502343
H 3.928172 -3.498837 -2.765383
H -6.345777 0.052037 2.750505
H -8.064303 -1.042964 -1.044460
H 2.598284 -5.413655 -1.896202
H -8.332191 -0.166910 1.268205


%chk=000259167-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259167

0 1
O -0.358130 -0.325267 -0.066148
O 4.135012 2.081203 1.357184
N 3.553182 -0.237054 1.307041
N -2.692635 -0.614306 -0.564313
C 0.747886 1.843416 -0.294178
C 1.939813 1.408589 0.406248
C 2.151771 -0.029708 0.884882
C -0.411112 1.008597 -0.537458
C -1.558477 1.481729 -1.200561
C -2.807087 0.621156 -1.359926
C 0.678030 3.202650 -0.805495
C 2.965853 2.354918 0.617349
C -1.373770 -1.202433 -0.690584
C 4.034466 0.836313 2.149339
C -1.573435 2.817562 -1.702396
C 3.893334 -1.611426 1.705921
C -0.481788 3.657414 -1.512386
C -3.849208 -1.522694 -0.608705
C 1.783077 4.092775 -0.602697
C 2.905021 3.684288 0.102586
C 3.912024 -2.590292 0.530043
C -5.079660 -0.950590 0.097659
C 3.539903 -3.943367 0.720357
C 4.348953 -2.170612 -0.750907
C -4.936735 -0.162645 1.266771
C -6.379915 -1.240394 -0.382373
C 3.613761 -4.867967 -0.347133
C 4.418893 -3.090586 -1.820005
C -6.075788 0.321021 1.946982
C -7.522335 -0.761749 0.300049
C 4.054981 -4.443891 -1.621746
C -7.373302 0.020433 1.468269
H 1.431945 -0.281358 1.701287
H 1.932666 -0.728514 0.063247
H -3.687921 1.186865 -1.003840
H -2.985361 0.400286 -2.445327
H -1.317760 -2.156880 -0.144953
H -1.048912 -1.345453 -1.751486
H 3.357226 1.069096 3.009345
H 5.052345 0.627920 2.513578
H -2.468619 3.176720 -2.224391
H 3.202985 -2.009653 2.491170
H 4.904501 -1.581820 2.161492
H -0.496685 4.685839 -1.890050
H -3.548564 -2.463404 -0.103616
H -4.131870 -1.799924 -1.655074
H 1.720061 5.110439 -1.004057
H 3.752625 4.349421 0.291454
H 3.189735 -4.275875 1.706308
H 4.617478 -1.117295 -0.890522
H -3.925294 0.070541 1.618929
H -6.501015 -1.839999 -1.293932
H 3.323796 -5.912748 -0.186290
H 4.757114 -2.753982 -2.806834
H -5.953281 0.931934 2.848709
H -8.523386 -0.992563 -0.081822
H 4.110853 -5.157849 -2.451415
H -8.257044 0.396175 1.996218


