%chk=000207575.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207575

0 1
O 1.088215 -0.234572 0.245197
O 2.469712 1.790816 -0.971431
O 6.447221 -0.009713 0.344043
N 2.408427 -0.439024 -0.213936
N 4.459193 0.883922 -0.291263
C -1.190888 -0.217103 -0.198227
C 3.059909 -1.290189 0.833259
C -2.327110 0.066477 -1.189685
C 0.161222 -0.199349 -0.905075
C 4.532372 -1.480315 0.474730
C -3.658854 0.025471 -0.488633
C 3.043453 0.843379 -0.485213
C 5.258450 -0.185228 0.201382
C -4.399359 -1.165535 -0.446206
C -4.163932 1.178038 0.132802
C -5.634005 -1.199784 0.207766
C -5.398652 1.137957 0.785409
C -6.136571 -0.049614 0.824093
H -1.349857 -1.192050 0.304149
H -1.195873 0.537260 0.617605
H 2.522759 -2.268062 0.838897
H 2.942259 -0.857663 1.852968
H -2.175910 1.055831 -1.670508
H -2.302651 -0.668271 -2.020240
H 0.335500 -1.075385 -1.547378
H 0.355376 0.734798 -1.463485
H 4.633982 -2.129350 -0.427726
H 5.057573 -2.031555 1.286622
H 4.935608 1.761669 -0.549778
H -4.013955 -2.064605 -0.921973
H -3.593610 2.104627 0.107753
H -6.205933 -2.125778 0.236674
H -5.787089 2.035011 1.265109
H -7.098084 -0.078109 1.331701


%chk=000207575-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207575

0 1
O 1.110199 -0.273460 0.567442
O 2.421182 2.005323 -0.360424
O 6.602535 -0.044914 -0.128661
N 2.495582 -0.308451 0.116970
N 4.492802 0.930771 -0.169262
C -1.227447 -0.202339 -0.005659
C 3.264368 -1.368417 0.803484
C -2.311586 -0.091077 -1.115786
C 0.180867 -0.226283 -0.603782
C 4.636583 -1.513383 0.119454
C -3.716664 -0.035637 -0.531985
C 3.064653 0.949154 -0.131169
C 5.353302 -0.175430 -0.053457
C -4.476226 -1.219235 -0.346453
C -4.279200 1.200256 -0.120105
C -5.762365 -1.171854 0.238148
C -5.564596 1.253420 0.464083
C -6.310921 0.065817 0.646535
H -1.398917 -1.115919 0.593841
H -1.311096 0.659331 0.681962
H 2.688584 -2.304003 0.722423
H 3.379072 -1.127426 1.880559
H -2.113208 0.818823 -1.715387
H -2.219324 -0.956327 -1.801465
H 0.352110 -1.119454 -1.237466
H 0.392361 0.692114 -1.181282
H 4.516251 -1.958934 -0.886806
H 5.293244 -2.180428 0.700756
H 4.923061 1.842187 -0.359809
H -4.058897 -2.182747 -0.665941
H -3.706848 2.125778 -0.262320
H -6.336699 -2.095879 0.371143
H -5.984870 2.217442 0.772666
H -7.308994 0.105185 1.097155


