%chk=000190367.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190367

0 1
O 0.605799 -3.192417 -0.054549
O 6.369275 -1.708068 -0.207129
O 4.884802 -3.281847 -0.247817
O -2.105977 5.575179 -0.747618
O -2.334058 5.207433 1.373361
N 0.409454 -0.890445 -0.056094
N 5.218045 -2.112369 -0.202381
N -1.831461 4.987347 0.284665
N -6.969990 -2.556818 -0.048058
C 2.137170 0.844822 -0.009012
C 1.788978 -0.530879 -0.060726
C 1.108144 1.907808 0.066091
C 3.486046 1.224968 -0.026343
C 2.807829 -1.500940 -0.123945
C 4.139541 -1.084772 -0.135964
C 4.498290 0.268208 -0.088500
C 0.758063 2.622621 -1.091027
C 0.495252 2.202757 1.295333
C -0.104584 -2.213063 -0.061585
C -0.201581 3.632052 -1.023641
C -0.463734 3.211869 1.372192
C -0.808676 3.916984 0.208941
C -1.604707 -2.249634 -0.061190
C -2.261187 -2.834029 1.029790
C -2.328545 -1.756767 -1.154523
C -3.655435 -2.913056 1.036964
C -3.722339 -1.837306 -1.154404
C -4.382909 -2.412349 -0.055430
C -5.816203 -2.492593 -0.051463
H 3.746378 2.285938 0.012855
H 2.568047 -2.580370 -0.162593
H -0.260171 -0.113800 -0.028417
H 5.554172 0.559365 -0.099824
H 1.242495 2.391926 -2.042003
H 0.780734 1.650904 2.193351
H -0.484750 4.203176 -1.916184
H -0.947275 3.460893 2.324679
H -1.684806 -3.236864 1.866720
H -1.809282 -1.324404 -2.011811
H -4.176306 -3.366782 1.882966
H -4.296041 -1.460275 -2.003577


%chk=000190367-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190367

0 1
O 0.571324 -3.229331 0.404682
O 6.466979 -1.726259 -0.232586
O 4.905070 -3.367290 0.029683
O -1.721780 5.994303 -0.971951
O -2.631536 5.134839 0.937334
N 0.438977 -0.911018 0.047619
N 5.248080 -2.133070 -0.104600
N -1.772009 5.119259 -0.025098
N -7.076139 -2.783823 0.135100
C 2.145589 0.843210 -0.109488
C 1.809341 -0.551023 -0.000250
C 1.112226 1.922244 -0.089883
C 3.508313 1.209374 -0.249513
C 2.838465 -1.527321 0.005985
C 4.172464 -1.101060 -0.115122
C 4.538718 0.253254 -0.250905
C 1.108054 2.918486 -1.107261
C 0.151702 2.014312 0.960292
C -0.119733 -2.185767 0.209036
C 0.168884 3.966410 -1.094182
C -0.792664 3.058503 0.989655
C -0.773772 4.017926 -0.044999
C -1.626953 -2.241097 0.161019
C -2.236213 -3.408388 0.690703
C -2.448697 -1.225112 -0.397623
C -3.633434 -3.554148 0.688923
C -3.849439 -1.362999 -0.407432
C -4.453065 -2.526888 0.142820
C -5.886099 -2.667171 0.137664
H 3.759770 2.272394 -0.321866
H 2.598123 -2.587638 0.100274
H -0.218417 -0.130935 -0.024733
H 5.591273 0.529862 -0.341501
H 1.834940 2.853648 -1.923416
H 0.178663 1.293732 1.785112
H 0.149152 4.733255 -1.872979
H -1.525067 3.149480 1.796119
H -1.586385 -4.191583 1.092858
H -2.018509 -0.331853 -0.866472
H -4.098120 -4.453530 1.103685
H -4.479577 -0.582785 -0.844603


