%chk=000186360.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186360

0 1
O 1.164176 3.011634 0.815680
O 2.542369 2.819319 -0.829347
N 1.782812 2.345219 0.001963
C 0.095316 -1.071060 -0.013565
C 0.255555 0.353430 0.015459
C 1.272815 -1.921499 -0.001521
C 2.539256 -1.376417 0.026946
C 2.718199 0.058246 0.028891
C 1.605609 0.877732 0.018842
C -1.201826 -1.607153 -0.047136
C -0.882209 1.173949 0.026105
C -2.339211 -0.789898 -0.047382
C -2.174085 0.630996 -0.005416
C 1.102348 -3.407414 -0.015243
C 3.735469 -2.277076 0.051161
C 4.086998 0.649286 0.057606
C -3.676066 -1.337094 -0.084677
C -3.352355 1.468548 0.004009
C -4.761949 -0.514183 -0.077057
C -4.596532 0.914604 -0.030901
H -1.328495 -2.694183 -0.073130
H -0.776743 2.262156 0.080439
H 1.544817 -3.866277 0.882366
H 0.049618 -3.727766 -0.048594
H 1.597929 -3.857024 -0.889450
H 3.756741 -2.936679 -0.828624
H 4.689966 -1.725614 0.054209
H 3.735854 -2.914738 0.947093
H 4.255415 1.250607 0.964251
H 4.890272 -0.104693 0.022429
H 4.249376 1.325765 -0.803847
H -3.786538 -2.419743 -0.118607
H -3.211859 2.548853 0.040971
H -5.774954 -0.912877 -0.104855
H -5.491991 1.535145 -0.024367


%chk=000186360-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186360

0 1
O 1.127649 3.039561 1.006459
O 2.612065 2.886342 -0.713681
N 1.792628 2.351162 0.134236
C 0.100920 -1.078591 0.004784
C 0.252839 0.371454 0.059948
C 1.276494 -1.936284 -0.008579
C 2.565036 -1.373648 -0.003826
C 2.743412 0.068730 0.068557
C 1.605881 0.884534 0.094049
C -1.208433 -1.618941 -0.059456
C -0.901176 1.191535 0.049546
C -2.364869 -0.802527 -0.074181
C -2.204159 0.642201 -0.020316
C 1.056993 -3.440124 -0.009690
C 3.815216 -2.241294 -0.073010
C 4.150933 0.629941 0.174043
C -3.694326 -1.353387 -0.142931
C -3.379985 1.474578 -0.032937
C -4.808742 -0.520049 -0.155836
C -4.649801 0.909240 -0.099928
H -1.344956 -2.703388 -0.111343
H -0.797847 2.277853 0.113638
H 1.988200 -4.005520 0.129980
H 0.373510 -3.735169 0.807612
H 0.594231 -3.779885 -0.956572
H 3.631897 -3.187127 -0.605383
H 4.631711 -1.727282 -0.604996
H 4.194908 -2.495541 0.936640
H 4.170247 1.667565 0.535021
H 4.761183 0.014183 0.856445
H 4.649864 0.631013 -0.813459
H -3.814332 -2.442647 -0.183799
H -3.255997 2.562883 0.011241
H -5.816416 -0.946557 -0.207735
H -5.538683 1.549287 -0.109840


