%chk=000243910.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000243910

0 1
O 2.534763 1.388266 0.867293
N 1.323502 -1.090108 1.452713
N 2.484190 -0.883704 0.669532
C -2.834678 -0.213071 0.504477
C -4.197570 -0.145784 -0.235002
C -1.747277 0.576874 -0.256093
C -2.368074 -1.674536 0.681580
C -5.285416 -0.934065 0.526694
C -4.664451 1.315614 -0.411109
C -0.400419 0.513907 0.470751
C -1.024300 -1.752054 1.415616
C 0.049554 -0.948394 0.652002
C -6.631947 -0.876377 -0.207627
C -6.007648 1.386149 -1.150232
C -7.087779 0.573178 -0.423599
C 3.048072 0.373957 0.422634
C 4.309820 0.339404 -0.382506
C 4.339701 -0.258758 -1.648843
C 5.455921 0.952491 0.141045
C 5.526391 -0.252977 -2.387221
C 6.640565 0.950448 -0.600836
C 6.676208 0.347391 -1.862465
H -2.957728 0.242635 1.516259
H -4.075462 -0.601111 -1.246792
H -2.053719 1.635177 -0.368482
H -1.642652 0.181739 -1.283974
H -2.288660 -2.165937 -0.306506
H -3.126945 -2.250257 1.246084
H -5.398303 -0.524021 1.547994
H -4.976706 -1.988899 0.652245
H -3.904276 1.895903 -0.967505
H -4.755661 1.801345 0.578699
H 0.367706 1.087946 -0.085608
H -0.475954 1.020284 1.452555
H -1.132335 -1.368088 2.447797
H -0.703018 -2.806191 1.518477
H 0.206127 -1.413431 -0.354049
H -7.396679 -1.430409 0.367571
H -6.549018 -1.391635 -1.183642
H -5.887137 1.008719 -2.183661
H -6.328513 2.440160 -1.244449
H -8.029805 0.592372 -1.001496
H -7.315530 1.042751 0.552421
H 1.316900 -0.404175 2.235022
H 2.912677 -1.758197 0.365036
H 3.441497 -0.715257 -2.063586
H 5.415881 1.435890 1.118900
H 5.554402 -0.713815 -3.373542
H 7.534396 1.424160 -0.196796
H 7.600290 0.348892 -2.439878


%chk=000243910-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000243910

0 1
O 2.774466 0.848061 1.525698
N 1.349130 -1.521198 1.165658
N 2.452697 -1.122677 0.345948
C -2.830710 -0.267291 0.427791
C -4.249948 -0.169376 -0.221569
C -1.712698 0.260287 -0.514689
C -2.483574 -1.718388 0.865806
C -5.366552 -0.710442 0.715756
C -4.601833 1.283714 -0.650656
C -0.301568 0.141525 0.108085
C -1.068296 -1.844553 1.477182
C 0.011346 -1.318919 0.511110
C -6.778707 -0.595394 0.093108
C -6.013060 1.398385 -1.275413
C -7.101885 0.856945 -0.322678
C 3.149808 0.054377 0.599978
C 4.370149 0.302021 -0.243238
C 4.566354 -0.295338 -1.516662
C 5.341440 1.205900 0.257785
C 5.728955 -0.008166 -2.264456
C 6.502646 1.490994 -0.489894
C 6.702429 0.880493 -1.750892
H -2.832812 0.370925 1.341432
H -4.243382 -0.800976 -1.140452
H -1.893441 1.318370 -0.777410
H -1.748958 -0.314798 -1.465723
H -2.561268 -2.385698 -0.019644
H -3.217875 -2.086384 1.605309
H -5.338978 -0.136654 1.667414
H -5.175962 -1.768474 0.974795
H -3.857732 1.664308 -1.374705
H -4.543968 1.941271 0.243691
H 0.462351 0.510508 -0.602534
H -0.232216 0.781965 1.010708
H -1.024121 -1.256464 2.419022
H -0.849586 -2.896446 1.739703
H 0.005543 -1.950648 -0.401148
H -7.536511 -0.970112 0.809048
H -6.834540 -1.249163 -0.802626
H -6.039332 0.818338 -2.221822
H -6.221767 2.453224 -1.541582
H -8.098291 0.909116 -0.803516
H -7.147164 1.496649 0.583407
H 1.412505 -0.952343 2.031101
H 2.885243 -1.880453 -0.184120
H 3.801569 -0.951904 -1.948821
H 5.157113 1.674917 1.229856
H 5.870754 -0.465699 -3.249786
H 7.249754 2.187472 -0.093903
H 7.603384 1.102594 -2.333555


