%chk=000250541.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250541

0 1
O -3.865822 -2.013999 0.615712
O 2.033656 1.268794 1.978957
O -1.296352 -2.346984 1.286198
O 4.044099 1.989121 0.018044
N -0.576876 -2.299404 -0.893692
C 0.817614 -2.661807 -0.536286
C -2.905317 -1.586300 -0.340707
C 1.686482 -1.432651 -0.408479
C -2.890713 -0.078536 -0.466442
C -1.517433 -2.097274 0.112257
C 1.526126 -0.600146 0.707785
C 2.635987 -1.126672 -1.389097
C 2.316416 0.548807 0.845046
C -2.311659 0.715295 0.533862
C -3.483186 0.525649 -1.583436
C 3.436588 0.013743 -1.261006
C 3.279645 0.849609 -0.153211
C -2.317265 2.106937 0.409925
C -3.486955 1.918645 -1.702341
C -2.903171 2.709997 -0.708039
C 2.835581 2.447013 2.252702
H 1.204439 -3.363649 -1.308790
H 0.810070 -3.228198 0.431648
H -3.254504 -2.091341 -1.273806
H -0.702257 -1.882601 -1.811841
H 0.787620 -0.837144 1.480531
H 2.763100 -1.772047 -2.255547
H -1.853683 0.249438 1.409112
H -3.952514 -0.083592 -2.354247
H 4.176651 0.247044 -2.022560
H -1.862465 2.720894 1.186623
H -3.949610 2.387306 -2.569433
H -2.906834 3.794581 -0.802608
H -3.527582 -1.860913 1.538873
H 4.688706 2.097738 -0.724825
H 2.698743 3.186428 1.456783
H 3.890058 2.170458 2.352749
H 2.412917 2.788057 3.204387


%chk=000250541-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000250541

0 1
O -3.893570 -2.054823 1.135612
O 2.165508 1.871852 1.525934
O -1.493567 -3.167676 1.010938
O 4.476974 2.031666 -0.202822
N -0.729973 -1.803916 -0.725114
C 0.665578 -2.283075 -0.691855
C -3.143162 -1.709355 -0.058511
C 1.674070 -1.147075 -0.576321
C -3.164186 -0.207384 -0.309701
C -1.696156 -2.279596 0.118342
C 1.524493 -0.146829 0.414479
C 2.797054 -1.093780 -1.434253
C 2.460981 0.898923 0.560468
C -3.068309 0.700165 0.773854
C -3.241542 0.295540 -1.632475
C 3.744059 -0.055129 -1.302345
C 3.580227 0.949801 -0.324029
C -3.029972 2.090138 0.533496
C -3.200105 1.689016 -1.873650
C -3.088463 2.589422 -0.790272
C 3.250690 2.332519 2.418878
H 0.879213 -2.880702 -1.599442
H 0.725682 -2.968094 0.174561
H -3.575860 -2.231924 -0.941329
H -0.960597 -1.013159 -1.333748
H 0.669392 -0.155040 1.098919
H 2.936485 -1.858805 -2.206495
H -3.052447 0.303849 1.794200
H -3.364369 -0.398849 -2.474612
H 4.608101 -0.012291 -1.979375
H -2.955759 2.786640 1.376119
H -3.266748 2.068237 -2.899552
H -3.057646 3.669288 -0.972874
H -3.353423 -2.761221 1.600509
H 5.177740 1.976477 -0.898941
H 4.042019 2.847101 1.851590
H 3.679513 1.476722 2.975024
H 2.758374 3.023663 3.119594


