%chk=000240697.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240697

0 1
O -3.128620 2.397924 0.522095
O -2.639243 -1.875342 -1.458637
O 3.678388 2.047820 0.198048
N -1.914337 0.041520 -0.493962
N -1.759615 -3.507621 0.627270
C -1.263586 0.807557 0.594683
C -2.791682 0.869518 -1.364685
C -1.098620 -2.203671 0.370271
C -1.952125 -1.344415 -0.592202
C -2.325861 1.581197 1.396052
C -3.804571 1.638831 -0.503522
C 0.288001 -2.457701 -0.261714
C 1.202068 -1.277695 -0.104978
C 1.337659 -0.341035 -1.149121
C 1.927392 -1.099979 1.079158
C 2.175367 0.757737 -1.010534
C 2.777895 -0.001461 1.244583
C 2.893463 0.915751 0.194331
C 4.499113 2.299026 1.363886
H -0.534812 1.519257 0.135709
H -0.674214 0.138589 1.260396
H -3.313345 0.214528 -2.103889
H -2.152191 1.576749 -1.938860
H -0.972407 -1.683812 1.357639
H -2.986731 0.908630 1.969213
H -1.873150 2.332911 2.067995
H -4.322899 2.430368 -1.074253
H -4.542100 0.968725 -0.029218
H 0.174721 -2.736936 -1.330396
H 0.736254 -3.357908 0.218423
H -1.902807 -4.014883 -0.247611
H -2.682378 -3.369231 1.033323
H 0.773799 -0.477229 -2.073673
H 1.834798 -1.826921 1.887112
H 2.296470 1.490303 -1.805595
H 3.334589 0.116920 2.167500
H 3.871038 2.450944 2.245863
H 5.010722 3.228621 1.080644
H 5.216758 1.486114 1.506955


%chk=000240697-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240697

0 1
O -3.059409 2.543945 0.599113
O -2.242753 -1.756188 -1.751486
O 3.637227 2.128649 -0.013203
N -1.966631 0.018154 -0.277820
N -1.884720 -3.612762 0.357682
C -1.415579 0.699617 0.914613
C -2.567064 0.960113 -1.254976
C -1.154327 -2.328210 0.349549
C -1.823547 -1.317670 -0.626264
C -2.504568 1.581093 1.561917
C -3.629156 1.827110 -0.558591
C 0.315927 -2.593971 -0.113696
C 1.217667 -1.372141 -0.069862
C 1.312911 -0.486505 -1.179005
C 1.972878 -1.063585 1.086880
C 2.119089 0.665136 -1.129838
C 2.790508 0.089297 1.159002
C 2.860727 0.959170 0.042991
C 4.446657 2.458618 1.161364
H -0.561854 1.334537 0.602454
H -1.035215 -0.028412 1.646578
H -3.001597 0.364330 -2.074764
H -1.768838 1.609444 -1.668400
H -1.134118 -1.950886 1.386538
H -3.319333 0.939653 1.965206
H -2.078682 2.190881 2.375918
H -4.002545 2.613880 -1.234117
H -4.477400 1.191165 -0.224316
H 0.263990 -3.003809 -1.140833
H 0.697537 -3.395041 0.544118
H -2.068922 -3.917561 -0.609447
H -2.767758 -3.562603 0.881975
H 0.750611 -0.710888 -2.093732
H 1.933361 -1.741235 1.949360
H 2.201927 1.343098 -1.985026
H 3.366479 0.286706 2.068324
H 3.813809 2.622683 2.055792
H 4.965825 3.392221 0.899603
H 5.190085 1.665671 1.374696


