%chk=000252083.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252083

0 1
O -0.308503 -0.718210 0.758987
O -1.716746 0.899989 -0.738608
O 0.084826 -2.180125 -0.929533
O 6.698034 0.235732 -0.181227
O 5.846724 2.163370 0.310613
N 5.756515 0.977892 0.041107
C 1.854729 -0.708072 -0.123648
C -3.875372 0.132883 -0.108562
C -1.724683 -1.003374 0.700131
C -2.385355 0.097404 -0.129742
C 2.968321 -1.522286 -0.379618
C 2.003654 0.652978 0.176252
C 4.391619 0.389981 -0.019095
C 0.493500 -1.306899 -0.205125
C 4.249104 -0.971503 -0.325424
C 3.283286 1.210491 0.229502
C -4.651518 -0.995650 0.194724
C -4.505720 1.347713 -0.424949
C -6.045222 -0.903874 0.193272
C -5.899843 1.437125 -0.419816
C -6.669665 0.311858 -0.109842
H -1.901681 -2.011804 0.274764
H -2.029661 -0.971840 1.763248
H 2.829994 -2.578700 -0.627669
H 1.115711 1.269019 0.363684
H 5.136141 -1.585198 -0.520621
H 3.425914 2.272412 0.461315
H -4.180705 -1.951672 0.421263
H -3.894378 2.218374 -0.680000
H -6.647811 -1.781217 0.425782
H -6.385063 2.382152 -0.662250
H -7.757945 0.379550 -0.107516


%chk=000252083-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000252083

0 1
O -0.314473 -0.457992 0.984024
O -1.788980 0.987502 -0.778261
O -0.021149 -1.823362 -0.886274
O 6.748628 0.192811 -0.888858
O 6.311113 1.617119 0.838007
N 5.952477 0.727479 -0.025392
C 1.861886 -0.535677 -0.016961
C -3.955299 0.131402 -0.129603
C -1.750418 -0.744996 0.934248
C -2.462055 0.201209 -0.059155
C 2.773313 -1.096072 -0.949343
C 2.298526 0.447009 0.908730
C 4.530380 0.289107 -0.024378
C 0.446003 -1.008023 -0.058146
C 4.118393 -0.686372 -0.959148
C 3.642105 0.865533 0.909907
C -4.716798 -0.776306 0.656965
C -4.626673 1.008437 -1.025552
C -6.122990 -0.803508 0.548476
C -6.030247 0.979970 -1.131774
C -6.782004 0.073746 -0.344279
H -1.916942 -1.795554 0.627529
H -2.112160 -0.588989 1.963428
H 2.406553 -1.845731 -1.657089
H 1.580328 0.875874 1.611276
H 4.844373 -1.098568 -1.664228
H 4.011497 1.620622 1.608128
H -4.225663 -1.467660 1.350561
H -4.021812 1.696996 -1.624878
H -6.704758 -1.506053 1.154570
H -6.540735 1.657852 -1.824031
H -7.874214 0.050695 -0.427098


