%chk=000207381.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207381

0 1
I 2.457666 -3.419233 0.892424
I 2.934817 1.887254 -1.937870
I -1.110865 -3.162583 0.759885
I -0.641053 2.157913 -2.014960
O 5.894591 1.805128 1.736674
O 4.407731 -1.367233 -1.451580
O -5.132845 2.291340 -0.363024
O -3.899706 2.611959 1.480036
O -2.625919 -0.858268 -1.636474
N 4.511858 -0.405212 0.615260
N -2.584066 0.185016 0.406189
C -6.128780 -0.812287 1.478576
C -4.643835 -0.427181 1.663528
C -4.051459 0.345918 0.474335
C 3.905667 0.375107 1.720323
C 5.998876 -0.352421 0.585143
C 4.453979 1.814028 1.718130
C 6.470608 1.109373 0.610531
C -7.030582 0.420613 1.376252
C -6.317509 -1.733025 0.268984
C 3.828933 -0.844994 -0.516987
C 2.314566 -0.719593 -0.502611
C -4.309392 1.847904 0.640134
C -1.989851 -0.436074 -0.696031
C -0.478615 -0.522269 -0.599140
C 1.518335 -1.741192 0.030465
C 1.705775 0.392589 -1.098677
C 0.128355 -1.642428 -0.019617
C 0.316815 0.493966 -1.143256
H -6.427191 -1.381884 2.397981
H -4.522500 0.149727 2.602032
H -4.055015 -1.358926 1.810834
H -4.513629 -0.015780 -0.497912
H 4.174723 -0.131847 2.678617
H 2.798492 0.376300 1.658726
H 6.378137 -0.880235 -0.322838
H 6.381534 -0.903484 1.473899
H 4.105493 2.391599 0.842106
H 4.210160 2.353457 2.651055
H 7.553572 1.196354 0.811315
H 6.211094 1.646045 -0.318906
H -8.089123 0.136790 1.395883
H -6.869169 0.971615 0.439908
H -6.864865 1.116452 2.205226
H -7.364710 -2.035046 0.157807
H -5.718326 -2.645906 0.355730
H -6.023110 -1.243930 -0.669643
H -2.043048 0.505233 1.206770
H -5.324013 3.266749 -0.307435


%chk=000207381-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207381

0 1
I 2.691728 -2.912185 1.894761
I 2.915240 1.408684 -2.412279
I -0.997085 -2.844215 1.775565
I -0.771622 1.478381 -2.539984
O 6.293032 1.913386 1.691029
O 4.417426 -1.704622 -1.168200
O -5.475397 2.314453 0.092855
O -3.737438 2.350477 1.630462
O -2.578112 -1.485256 -1.308187
N 4.637509 -0.140747 0.553189
N -2.640562 0.167464 0.330770
C -6.329878 -0.962792 1.078317
C -4.785093 -0.792245 1.158334
C -4.108971 0.319489 0.285921
C 4.082885 0.783273 1.565619
C 6.106089 -0.320580 0.619450
C 4.846994 2.123988 1.525167
C 6.803590 1.050898 0.609023
C -7.117132 0.045939 1.950602
C -6.849394 -0.979418 -0.380125
C 3.899867 -0.901197 -0.333561
C 2.379954 -0.750953 -0.279548
C -4.397109 1.739594 0.757454
C -1.987440 -0.717965 -0.491708
C -0.465025 -0.690392 -0.367378
C 1.619193 -1.598652 0.570266
C 1.710784 0.136355 -1.164532
C 0.202716 -1.570186 0.525967
C 0.294288 0.168217 -1.208568
H -6.519424 -1.970266 1.506347
H -4.474797 -0.645812 2.211727
H -4.315359 -1.730495 0.806839
H -4.435535 0.202559 -0.760849
H 4.193239 0.330242 2.571903
H 3.009815 0.950288 1.375131
H 6.413075 -0.937918 -0.241285
H 6.357006 -0.861993 1.554159
H 4.647774 2.645853 0.564793
H 4.542977 2.768006 2.366381
H 7.882725 0.942579 0.803058
H 6.649982 1.549218 -0.371982
H -8.188141 -0.227910 1.981291
H -7.051199 1.070163 1.545133
H -6.741857 0.056445 2.991371
H -7.907473 -1.298238 -0.409873
H -6.266024 -1.678550 -1.008040
H -6.794578 0.025884 -0.837459
H -2.127867 0.753303 0.997494
H -5.632776 3.234849 0.440979


