%chk=000298852.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298852

0 1
O -0.659081 0.689940 -1.573388
O 2.736495 -0.715896 1.361920
N 1.829229 0.338494 -0.442787
C -0.644814 0.352655 -0.167403
C -1.837945 1.029575 0.535522
C -0.672049 -1.180263 -0.005945
C 0.718808 0.946363 0.333349
C -3.182127 0.388487 0.172214
C -2.030677 -1.794079 -0.358037
C -3.170404 -1.124513 0.418504
C 0.777655 2.467541 0.171696
C 2.779867 -0.481289 0.163737
C 3.836976 -1.025315 -0.757971
H -1.861546 2.103446 0.264590
H -1.688609 0.986591 1.631447
H -0.398023 -1.442063 1.035861
H 0.112894 -1.632033 -0.643233
H 0.850463 0.673119 1.418295
H -3.426094 0.598330 -0.887076
H -3.988818 0.861378 0.764888
H -2.012281 -2.879498 -0.139443
H -2.213460 -1.710756 -1.446567
H -3.057092 -1.328459 1.501142
H -4.141248 -1.565460 0.125572
H 1.793229 2.845518 0.343352
H 0.474534 2.771457 -0.840415
H 0.119275 2.974710 0.884143
H -1.466628 0.342048 -1.997082
H 1.798133 0.495611 -1.446907
H 4.537313 -1.657826 -0.188109
H 3.416880 -1.646712 -1.558145
H 4.430446 -0.228203 -1.224025


%chk=000298852-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298852

0 1
O -0.630322 0.519023 -1.622272
O 3.222512 -0.135063 1.335180
N 1.776659 0.189385 -0.457756
C -0.661023 0.279196 -0.144206
C -1.856991 1.034617 0.487470
C -0.773080 -1.243783 0.138699
C 0.713635 0.831018 0.340511
C -3.227625 0.433643 0.086512
C -2.139680 -1.837491 -0.277113
C -3.306832 -1.078910 0.396321
C 0.845106 2.369898 0.264113
C 2.970139 -0.234720 0.091851
C 3.972540 -0.836806 -0.891347
H -1.816077 2.097526 0.190175
H -1.753217 0.996342 1.591175
H -0.629899 -1.405139 1.226258
H 0.053610 -1.767274 -0.374926
H 0.877638 0.510162 1.386395
H -3.409275 0.597745 -0.997799
H -4.033453 0.979727 0.612442
H -2.170575 -2.911195 -0.012258
H -2.257990 -1.794839 -1.381714
H -3.251448 -1.229515 1.494074
H -4.279589 -1.489308 0.063909
H 1.877734 2.656097 0.527353
H 0.621406 2.731201 -0.754895
H 0.166718 2.872876 0.975634
H -1.467092 0.175017 -2.022674
H 1.593453 0.120602 -1.462009
H 4.240113 -1.853305 -0.554754
H 3.596230 -0.888746 -1.927869
H 4.897974 -0.235084 -0.876782


