%chk=000245516.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245516

0 1
O 1.634630 -1.286680 -0.189535
O -1.630966 -1.290968 0.174182
O 1.119416 0.434148 1.243586
O -1.118183 0.445935 -1.240292
N 2.690999 0.680511 -0.488035
N -2.691849 0.670659 0.492338
C 0.621671 -2.122354 0.433532
C -0.616827 -2.118428 -0.457886
C 1.723689 0.027667 0.272944
C -1.722492 0.027903 -0.274573
C 2.708081 2.160761 -0.453114
C -2.712084 2.151151 0.473076
H 1.120903 -3.107307 0.471488
H 0.396928 -1.758178 1.457549
H -1.114658 -3.103617 -0.506532
H -0.392554 -1.742851 -1.477883
H 2.970290 0.253383 -1.372147
H -2.971452 0.233500 1.371418
H 2.423088 2.525767 0.552945
H 2.015831 2.609708 -1.185678
H 3.733813 2.509351 -0.662295
H -2.019980 2.593837 1.209591
H -3.738291 2.495412 0.687009
H -2.428902 2.527291 -0.529391


%chk=000245516-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245516

0 1
O 1.423548 -1.092009 -0.506525
O -1.421356 -1.100019 0.494303
O 1.910869 -0.061989 1.574780
O -1.910885 -0.051822 -1.577391
N 2.342344 0.976525 -0.493616
N -2.343701 0.966960 0.500527
C 0.742691 -2.210178 0.176308
C -0.737873 -2.210254 -0.198779
C 1.896402 -0.039417 0.317620
C -1.896161 -0.040717 -0.320083
C 2.936223 2.201268 0.044822
C -2.939720 2.195599 -0.026546
H 1.224233 -3.137589 -0.182388
H 0.882455 -2.105741 1.267035
H -1.217149 -3.142058 0.151457
H -0.877976 -2.096192 -1.288494
H 2.225555 0.852260 -1.499603
H -2.226264 0.833750 1.505292
H 2.935850 2.123264 1.143617
H 2.351108 3.093284 -0.246794
H 3.979085 2.329354 -0.300533
H -2.355771 3.085823 0.272786
H -3.982583 2.319005 0.320502
H -2.939823 2.127495 -1.125999


