%chk=000215714.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215714

0 1
O 2.320303 -2.082136 0.133876
O 7.548088 1.167206 -1.111303
N -1.692852 -1.679035 -0.118919
N -4.296541 -0.406163 -0.026794
C -2.802085 -2.235715 0.722788
C -2.274141 -1.010723 -1.329742
C -3.726688 -1.088481 1.176685
C -3.199331 0.139940 -0.885075
C -0.720380 -2.750086 -0.516325
C 0.243798 -3.032108 0.647763
C -5.449351 0.409010 0.164017
C 1.134364 -1.835488 0.965914
C -6.326203 0.171268 1.248721
C -5.804460 1.386952 -0.794967
C -7.517377 0.886196 1.356505
C -7.000328 2.090665 -0.668382
C -7.863209 1.851014 0.405501
C 3.305319 -1.138278 0.096224
C 3.296045 0.074796 0.803018
C 4.384014 -1.495608 -0.745037
C 5.466074 0.608806 -0.164060
C 4.384299 0.937824 0.661908
C 5.449715 -0.618858 -0.865422
C 6.653270 1.488486 -0.354773
C 6.694796 2.787186 0.429902
C 7.970973 3.573794 0.157974
H -3.399833 -3.009979 0.192664
H -2.354675 -2.718606 1.617871
H -1.439686 -0.590892 -1.932429
H -2.837513 -1.712535 -1.983254
H -4.555149 -1.509531 1.790876
H -3.162823 -0.376543 1.820029
H -2.609426 0.915962 -0.347724
H -3.639940 0.621418 -1.787961
H -0.128690 -2.396992 -1.391862
H -1.214055 -3.694081 -0.831946
H -0.316864 -3.326890 1.556374
H 0.886146 -3.901740 0.383784
H 0.682028 -0.871208 0.672308
H 1.461618 -1.812398 2.017661
H -6.084573 -0.581457 1.996027
H -5.154817 1.584462 -1.645074
H -8.185683 0.689723 2.194823
H -7.263497 2.838114 -1.416822
H -8.791411 2.405918 0.498507
H 2.467586 0.349536 1.446085
H 4.356753 -2.443768 -1.276706
H 4.374535 1.880749 1.211425
H 6.301484 -0.865295 -1.510742
H 5.809395 3.402939 0.169807
H 6.611066 2.566698 1.513870
H 8.073704 3.807669 -0.910786
H 7.991708 4.513909 0.717421
H 8.862500 2.992456 0.430473


%chk=000215714-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215714

0 1
O 2.127371 -2.201018 0.039288
O 6.968389 1.711334 -1.544564
N -1.624072 -1.986271 -0.001028
N -4.035634 -0.370765 -0.001890
C -2.772218 -2.331671 0.871238
C -2.128099 -1.365444 -1.249585
C -3.577707 -1.070534 1.220760
C -2.936213 -0.090719 -0.945944
C -0.711859 -3.132039 -0.247571
C 0.234096 -3.391149 0.946026
C -5.133401 0.526679 0.073166
C 1.189470 -2.222705 1.187946
C -6.261466 0.237205 0.902351
C -5.175925 1.726929 -0.700738
C -7.371196 1.102859 0.947636
C -6.298785 2.580944 -0.654495
C -7.407096 2.283876 0.168531
C 3.085760 -1.190421 -0.015939
C 3.227964 -0.162778 0.953250
C 3.960288 -1.237142 -1.136090
C 5.121241 0.774306 -0.320303
C 4.239673 0.805513 0.792028
C 4.959916 -0.267748 -1.280787
C 6.209715 1.781454 -0.530089
C 6.390772 2.900068 0.505905
C 7.545442 3.857868 0.167155
H -3.447475 -3.073163 0.372759
H -2.400148 -2.785140 1.807794
H -1.265968 -1.096774 -1.887032
H -2.778238 -2.072990 -1.824292
H -4.442919 -1.358923 1.836906
H -2.934739 -0.395378 1.831869
H -2.247734 0.691007 -0.547392
H -3.360917 0.276086 -1.896237
H -0.092428 -2.893409 -1.131262
H -1.277608 -4.066821 -0.484961
H -0.348028 -3.564240 1.871933
H 0.821130 -4.309525 0.756638
H 0.620918 -1.272699 1.220769
H 1.768533 -2.354870 2.123652
H -6.290198 -0.683083 1.494385
H -4.326434 2.015783 -1.326059
H -8.221664 0.844362 1.589585
H -6.296354 3.494712 -1.260593
H -8.273709 2.951967 0.204676
H 2.564716 -0.111577 1.821096
H 3.831323 -2.041345 -1.866907
H 4.333708 1.590946 1.549536
H 5.643896 -0.286089 -2.135695
H 5.436164 3.459452 0.589463
H 6.553037 2.434625 1.499908
H 7.383309 4.338503 -0.812604
H 7.636735 4.645076 0.937137
H 8.502667 3.312976 0.103367


