%chk=000231877.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231877

0 1
O 2.810158 -1.759551 -0.702247
O -1.760975 -0.866053 -0.292904
O 3.664243 -1.221184 1.296049
O -0.989231 0.188623 1.599410
N 0.460820 -0.657182 -0.033463
C 2.106895 1.281393 -0.263555
C 1.674552 -0.010001 0.497044
C 1.149033 2.422971 0.077082
C 2.195378 1.061800 -1.773238
C 2.812777 -1.031229 0.464791
C -0.773987 -0.356539 0.537747
C -3.139187 -0.725546 0.177995
C -3.743307 0.476270 -0.477355
C -5.012172 0.834206 -0.301535
H 3.127362 1.552872 0.117582
H 1.494925 0.255370 1.586109
H 1.461420 3.357160 -0.404757
H 1.102566 2.613047 1.157233
H 0.123454 2.217132 -0.252828
H 1.206512 0.986355 -2.240008
H 2.712403 1.896909 -2.261211
H 2.747055 0.144794 -2.023123
H 0.509728 -1.028635 -0.985163
H 3.529028 -2.449145 -0.723804
H -3.587962 -1.678623 -0.164384
H -3.153686 -0.663810 1.285135
H -3.056342 1.034817 -1.117624
H -5.450781 1.701379 -0.776254
H -5.711580 0.301199 0.326874


%chk=000231877-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231877

0 1
O 2.511894 -2.054435 -0.445148
O -1.811476 -1.177818 -0.373789
O 3.785422 -0.819510 1.054034
O -1.128878 0.131964 1.475856
N 0.360577 -0.534248 -0.216445
C 2.038068 1.382420 -0.218488
C 1.557394 0.022069 0.414436
C 0.959129 2.469303 -0.023266
C 2.413009 1.225687 -1.709530
C 2.723714 -0.964003 0.413657
C -0.871007 -0.460931 0.396091
C -3.233253 -1.044524 0.079573
C -3.898556 0.120786 -0.610911
C -4.391980 1.198691 0.047643
H 2.945030 1.668137 0.351017
H 1.303464 0.228153 1.471780
H 1.327352 3.441532 -0.398663
H 0.685620 2.586632 1.040164
H 0.038259 2.216385 -0.579248
H 1.535877 0.909067 -2.304632
H 2.759870 2.192323 -2.116782
H 3.222716 0.488656 -1.864061
H 0.458963 -1.130118 -1.039346
H 3.308176 -2.651139 -0.424896
H -3.682111 -2.008781 -0.212448
H -3.249052 -0.926673 1.176359
H -3.968428 0.058204 -1.705973
H -4.880626 2.022699 -0.484764
H -4.310069 1.288272 1.137381


