%chk=000244747.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244747

0 1
O -3.173067 0.180435 2.167821
N -2.870440 -1.631916 -0.593331
N -2.537837 -2.777272 -0.292989
C -1.127834 -1.362171 1.072838
C -2.119644 -0.564883 0.161120
C -1.474364 -2.847731 0.755593
C 0.307417 -1.019251 0.783738
C -3.099227 0.302827 0.964135
C 1.101520 -0.454841 1.792938
C 0.865853 -1.250827 -0.483585
C -3.881001 1.329665 0.221974
C 2.993330 -0.362752 0.274914
C 2.436152 -0.130387 1.541697
C 2.198119 -0.924447 -0.737284
C 4.407132 -0.018748 0.007151
C -4.281343 2.477540 0.929650
C -4.242516 1.181285 -1.124120
C 4.732394 0.864077 -1.034927
C 5.428475 -0.574057 0.794308
C -5.015868 3.476088 0.288688
C -4.985626 2.180523 -1.759854
C -5.367702 3.327876 -1.057800
C 6.068531 1.187985 -1.283818
C 6.762742 -0.248583 0.537583
C 7.084936 0.632444 -0.499860
H -1.369651 -1.151637 2.147568
H -1.577432 0.079861 -0.574675
H -0.611783 -3.432122 0.378700
H -1.862700 -3.390554 1.640448
H 0.679193 -0.264235 2.779707
H 0.258706 -1.689008 -1.275551
H 3.046053 0.311308 2.329618
H 2.627008 -1.111401 -1.721626
H -4.016671 2.575504 1.985846
H -3.964455 0.282695 -1.681116
H 3.942057 1.300657 -1.643371
H 5.179518 -1.263233 1.599670
H -5.319762 4.365991 0.837727
H -5.269487 2.060861 -2.804605
H -5.943790 4.106088 -1.558272
H 6.318219 1.875393 -2.090569
H 7.553428 -0.682967 1.147402
H 8.124919 0.885323 -0.696779


%chk=000244747-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244747

0 1
O -3.264429 0.179973 2.249092
N -2.768448 -1.343777 -0.788349
N -2.482499 -2.553508 -0.496384
C -1.105165 -1.211661 1.051931
C -2.066762 -0.346222 0.189859
C -1.550269 -2.666550 0.692507
C 0.364433 -0.936133 0.768880
C -3.154628 0.394718 1.005244
C 1.218313 -0.443365 1.787044
C 0.923298 -1.153120 -0.519296
C -4.042715 1.365899 0.298079
C 3.142397 -0.394505 0.244135
C 2.579030 -0.176667 1.530828
C 2.282832 -0.889782 -0.775877
C 4.582004 -0.115743 -0.026565
C -4.882144 2.204030 1.084886
C -4.078627 1.474283 -1.119644
C 5.011611 0.346553 -1.301625
C 5.566504 -0.304063 0.983140
C -5.730620 3.142228 0.467987
C -4.934758 2.412487 -1.733882
C -5.756959 3.250458 -0.944740
C 6.373980 0.609973 -1.558501
C 6.929046 -0.039192 0.728793
C 7.341210 0.419183 -0.544286
H -1.321391 -1.009723 2.114609
H -1.542284 0.380227 -0.456619
H -0.717353 -3.331422 0.406044
H -2.120639 -3.161344 1.499515
H 0.809057 -0.255910 2.787326
H 0.294198 -1.545093 -1.329476
H 3.204504 0.234088 2.331396
H 2.690966 -1.099026 -1.771236
H -4.847185 2.097723 2.174221
H -3.475198 0.802804 -1.736956
H 4.270786 0.530953 -2.088113
H 5.267721 -0.689972 1.964577
H -6.370265 3.787979 1.079324
H -4.967192 2.486105 -2.826213
H -6.417305 3.980691 -1.426071
H 6.679518 0.973322 -2.546234
H 7.669967 -0.199894 1.520124
H 8.398963 0.624397 -0.742771


