%chk=000268308.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268308

0 1
O 3.288735 3.301518 -0.005249
O -6.808352 -0.670136 -0.106526
N 3.683828 1.052471 -0.045003
N -1.325230 0.240532 -0.361995
C 3.225191 -0.274377 0.021539
C 1.838058 -0.523034 0.223219
C 0.934637 0.604037 0.350616
C 2.802549 2.186930 0.068031
C 1.393120 1.875709 0.275434
C 4.120595 -1.375255 -0.105110
C 1.382719 -1.863739 0.274643
C 5.126542 1.330688 -0.259437
C 3.639852 -2.668310 -0.041191
C 2.263019 -2.921059 0.148151
C -0.509460 0.353093 0.631616
C -2.724678 0.022312 -0.181688
C -3.470649 0.509425 0.906486
C -3.369774 -0.671479 -1.234062
C -4.849312 0.299207 0.964358
C -4.737703 -0.898107 -1.183972
C -5.461751 -0.407111 -0.080186
H 0.738769 2.746990 0.346928
H 5.183686 -1.201927 -0.255693
H 0.316205 -2.055678 0.409386
H 5.471822 0.916159 -1.220357
H 5.734932 0.922922 0.563574
H 5.293647 2.429760 -0.289153
H 4.326139 -3.511164 -0.139620
H 1.906712 -3.947942 0.188095
H -0.739217 0.291532 1.708406
H -2.981239 1.068167 1.704037
H -2.778624 -1.024519 -2.083228
H -5.428763 0.680046 1.799435
H -5.261228 -1.434262 -1.974108
H -7.278676 -0.297397 0.679828


%chk=000268308-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268308

0 1
O 2.904490 3.070431 -1.182968
O -7.040955 -0.274840 0.083369
N 3.617318 0.978694 -0.366014
N -1.480256 0.623995 -0.386534
C 3.331612 -0.311117 0.113440
C 1.963705 -0.748793 0.248302
C 0.896132 0.185432 -0.118479
C 2.596932 1.914305 -0.745755
C 1.228350 1.446119 -0.588084
C 4.390237 -1.198190 0.467213
C 1.723366 -2.069293 0.727509
C 5.015214 1.433591 -0.505518
C 4.113250 -2.490722 0.939956
C 2.773282 -2.934821 1.070807
C -0.530315 -0.187200 0.013048
C -2.853966 0.330429 -0.203313
C -3.377044 -0.485822 0.842785
C -3.768084 0.947778 -1.105359
C -4.763327 -0.697085 0.962745
C -5.150229 0.722868 -1.007331
C -5.649734 -0.104212 0.027690
H 0.437230 2.148547 -0.860778
H 5.429887 -0.877478 0.371062
H 0.695649 -2.429359 0.829182
H 5.568760 0.794771 -1.216685
H 5.530650 1.427655 0.471393
H 4.977249 2.462713 -0.893563
H 4.941626 -3.156417 1.205579
H 2.558612 -3.944370 1.435053
H -0.758772 -1.179991 0.444860
H -2.704866 -0.921314 1.590884
H -3.359000 1.596608 -1.885651
H -5.155703 -1.307806 1.786499
H -5.855665 1.182785 -1.704920
H -7.299535 -0.861889 0.836778


