%chk=000253112.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253112

0 1
O -4.779063 0.860860 -1.284923
O 5.934778 -0.059856 -0.166538
N -4.782502 1.243321 2.051794
C -2.499839 0.424282 -0.570245
C -1.899027 -0.801690 0.189565
C -0.402369 -0.927911 -0.117310
C 0.298137 0.348812 0.436004
C -4.029355 0.217255 -0.254214
C -1.846245 1.698513 -0.014743
C -2.840980 -1.966917 -0.160576
C -0.318303 1.623431 -0.185509
C -4.242857 -1.324714 -0.264228
C 0.232527 -2.167163 0.528669
C -2.329843 0.363838 -2.092810
C 1.797318 0.268731 0.241713
C 1.696943 -2.286856 0.094181
C 2.447675 -0.981744 0.113369
C -4.445950 0.793502 1.044166
C 2.571827 1.435189 0.252729
C 3.837561 -1.038248 -0.022523
C 3.962923 1.402624 0.118168
C 4.580060 0.155758 -0.021321
C 6.804527 1.096863 -0.172845
H -2.001387 -0.616025 1.291258
H -0.245802 -0.981938 -1.221210
H 0.121061 0.389076 1.543910
H -2.095387 1.841212 1.053792
H -2.241329 2.591380 -0.535902
H -2.813934 -2.756157 0.607413
H -2.552776 -2.445749 -1.112068
H -0.058791 1.670790 -1.261813
H 0.138000 2.520818 0.276365
H -4.743689 -1.619655 -1.203446
H -4.896733 -1.659034 0.556969
H -0.319355 -3.081189 0.242491
H 0.166166 -2.104800 1.631842
H -1.281709 0.481341 -2.389950
H -2.692126 -0.580031 -2.512551
H -2.906965 1.166896 -2.574811
H 1.749159 -2.703667 -0.935633
H 2.213789 -3.027699 0.739550
H -5.743679 0.741879 -1.152197
H 2.085906 2.406113 0.372407
H 4.361952 -1.984863 -0.127572
H 4.530396 2.324996 0.126659
H 6.738631 1.627245 0.781338
H 6.565741 1.747480 -1.018839
H 7.792321 0.634902 -0.298474


%chk=000253112-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000253112

0 1
O -4.919463 1.020902 -1.109177
O 6.055013 -0.080456 -0.080745
N -4.605208 0.961285 2.307346
C -2.551340 0.422078 -0.599980
C -1.924904 -0.801008 0.141189
C -0.414946 -0.930793 -0.121810
C 0.291739 0.371486 0.372248
C -4.063394 0.223636 -0.213755
C -1.874647 1.717042 -0.094982
C -2.865094 -1.987048 -0.206452
C -0.331873 1.647827 -0.265397
C -4.279305 -1.331852 -0.360623
C 0.225974 -2.149057 0.576802
C -2.442348 0.329856 -2.146004
C 1.818340 0.275481 0.210719
C 1.692017 -2.307494 0.127446
C 2.473508 -0.993987 0.135417
C -4.338503 0.638940 1.188831
C 2.627126 1.437607 0.186136
C 3.880168 -1.053411 0.039886
C 4.034912 1.384764 0.088053
C 4.665783 0.120449 0.014709
C 6.903986 1.111480 -0.101721
H -2.038058 -0.603704 1.231878
H -0.242797 -1.041835 -1.214235
H 0.077894 0.430699 1.465954
H -2.109067 1.860468 0.979286
H -2.272520 2.598391 -0.633269
H -2.856295 -2.759761 0.580998
H -2.552178 -2.474016 -1.149059
H -0.052923 1.694869 -1.336284
H 0.098411 2.551360 0.205403
H -4.701414 -1.510008 -1.366042
H -4.999353 -1.716351 0.382386
H -0.333851 -3.074345 0.341374
H 0.173557 -2.007562 1.676008
H -1.393797 0.421004 -2.472539
H -2.834994 -0.621353 -2.544928
H -3.021439 1.147060 -2.606256
H 1.707016 -2.719092 -0.903663
H 2.213075 -3.051079 0.760589
H -5.867639 0.903511 -0.844101
H 2.156491 2.424374 0.247628
H 4.392872 -2.020572 -0.015122
H 4.612012 2.314157 0.073600
H 6.791676 1.704177 0.827446
H 6.679763 1.752275 -0.977222
H 7.933417 0.730807 -0.175867


