%chk=000253013.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253013

0 1
O -2.927849 -0.191606 -1.971189
O -1.838962 0.739453 1.712907
O -2.990328 2.502802 -1.043265
O -1.716424 -2.083285 -1.569620
O -4.397319 -0.521466 1.372984
O 0.842533 -0.014435 1.738324
N 0.454841 0.002440 -0.508923
C -1.000589 -0.223217 -0.333885
C -1.651405 1.028548 0.321753
C -3.076070 1.384021 -0.162664
C -3.778817 0.216575 -0.872492
C -1.621106 -0.663190 -1.677623
C -4.134565 -0.967167 0.047966
C 1.301247 0.036156 0.605393
C 2.757253 0.148124 0.288433
C 3.629737 -0.824774 0.794422
C 3.248101 1.222479 -0.465528
C 4.998441 -0.729340 0.527016
C 4.618192 1.313548 -0.724068
C 5.491671 0.337074 -0.231765
H -1.141203 -1.086652 0.396029
H -0.994865 1.926077 0.225068
H -3.684210 1.772402 0.698144
H -4.672517 0.583533 -1.434858
H -1.049475 -0.393810 -2.592962
H -3.339895 -1.738688 0.047229
H -5.090340 -1.436351 -0.257497
H 0.828886 -0.000782 -1.453193
H -0.955004 0.522595 2.145472
H -2.694525 2.215916 -1.938956
H -2.354844 -2.441068 -2.227655
H -3.544219 -0.270783 1.833330
H 3.240785 -1.645414 1.400480
H 2.570870 1.991531 -0.836190
H 5.681024 -1.484392 0.916533
H 5.007012 2.148740 -1.305730
H 6.560036 0.410907 -0.436120


%chk=000253013-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000253013

0 1
O -3.079723 -0.474668 -1.857960
O -1.802225 0.428915 1.801077
O -2.956464 2.352088 -1.031162
O -0.964736 -1.101980 -2.690620
O -4.296874 -0.637743 1.701084
O 0.801555 0.036201 1.680878
N 0.428079 -0.006101 -0.614158
C -1.034623 -0.152057 -0.490810
C -1.700735 0.922603 0.427611
C -3.128947 1.261316 -0.049052
C -3.845355 0.051249 -0.684794
C -1.657917 -0.109740 -1.896849
C -4.100965 -1.108598 0.337120
C 1.260915 0.032765 0.479416
C 2.739465 0.068433 0.226446
C 3.598241 -0.247785 1.310209
C 3.301853 0.419539 -1.029807
C 4.997265 -0.233875 1.137384
C 4.702752 0.436703 -1.199377
C 5.553441 0.104969 -0.118843
H -1.264837 -1.148263 -0.059909
H -1.111017 1.858537 0.390260
H -3.714998 1.609023 0.821156
H -4.808575 0.390083 -1.113488
H -1.566568 0.897540 -2.352343
H -3.258253 -1.827193 0.263780
H -5.024250 -1.644946 0.064146
H 0.810226 -0.244420 -1.534263
H -0.848180 0.190408 2.058781
H -3.843369 2.611540 -1.387556
H -1.437307 -1.214837 -3.553395
H -3.402322 -0.305544 2.030782
H 3.143942 -0.494737 2.274903
H 2.662381 0.715603 -1.870026
H 5.653078 -0.483857 1.978146
H 5.130555 0.716557 -2.168002
H 6.640590 0.118773 -0.253466


