%chk=000199237.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000199237

1 1
O 1.677303 0.706395 -1.251440
O 0.550946 -0.459080 0.379713
N -3.002902 -0.438070 0.496862
N 2.736501 -1.015924 -0.204751
C -3.051621 0.758641 -0.481708
C -2.266676 -0.050592 1.759442
C -4.421770 -0.835101 0.836914
C -2.290530 -1.602788 -0.151850
C -1.720066 1.205316 -0.777370
C -0.571758 1.526261 -0.966216
C 0.819077 1.872508 -1.133057
C 1.568138 -0.300785 -0.289869
C 2.745721 -2.286065 0.558644
C 3.854318 -0.796259 -1.150319
H -3.655197 1.586322 -0.023393
H -3.588578 0.447080 -1.416327
H -2.669860 0.871863 2.208459
H -2.304153 -0.850857 2.518741
H -1.180247 0.128417 1.545211
H -4.994642 -1.128693 -0.062491
H -4.448329 -1.699335 1.529106
H -4.972052 -0.013265 1.332285
H -2.725589 -1.864020 -1.130244
H -1.208341 -1.356452 -0.318117
H -2.309420 -2.502759 0.486833
H 1.029822 2.383738 -2.104662
H 1.199979 2.487095 -0.285702
H 3.669555 -2.340453 1.165102
H 2.712697 -3.165585 -0.107057
H 1.886277 -2.335065 1.252516
H 3.857088 0.248998 -1.516568
H 3.792976 -1.465966 -2.025755
H 4.816635 -0.975120 -0.636932


%chk=000199237-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000199237

1 1
O 1.799023 0.842117 -1.132990
O 0.790946 -0.334582 0.644667
N -3.053465 -0.442298 0.485420
N 2.765981 -1.108624 -0.372378
C -3.075903 0.693157 -0.601411
C -2.383914 0.064122 1.766055
C -4.494824 -0.849073 0.767510
C -2.259099 -1.638418 -0.041333
C -1.742747 1.217606 -0.851642
C -0.558612 1.555003 -0.898358
C 0.855525 1.956181 -0.882346
C 1.731628 -0.233608 -0.206173
C 2.852095 -2.296727 0.499206
C 3.846514 -0.936940 -1.365851
H -3.757078 1.474106 -0.216736
H -3.532278 0.242546 -1.501321
H -2.879345 0.993940 2.085340
H -2.497329 -0.709462 2.541556
H -1.316531 0.236949 1.560074
H -4.969996 -1.180295 -0.169062
H -4.499829 -1.673720 1.495946
H -5.041772 0.012517 1.180943
H -2.699279 -1.972556 -0.993772
H -1.211273 -1.327453 -0.173767
H -2.313842 -2.447257 0.703877
H 1.075657 2.670620 -1.692532
H 1.096936 2.424307 0.090181
H 3.821970 -2.304279 1.028614
H 2.771478 -3.221461 -0.101616
H 2.039498 -2.267263 1.239134
H 3.672443 -0.035257 -1.965551
H 3.882294 -1.815728 -2.035334
H 4.820431 -0.847768 -0.850348


