%chk=000211841.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211841

0 1
O 2.573658 2.990612 0.422498
O -7.200132 -0.555354 0.865177
N -3.567082 -0.628483 0.095297
N 0.945594 2.459455 -1.080575
C -0.760557 -0.172702 -0.534536
C -1.382807 -1.538949 -0.656451
C -1.765671 0.942647 -0.594754
C -2.563585 -1.719942 0.313427
C -2.947857 0.710909 0.360584
C 0.571318 0.016487 -0.417680
C 1.552658 -1.100157 -0.396293
C -4.786330 -0.834993 0.937543
C 1.213391 1.322103 -0.273044
C 2.364086 -1.335219 0.735417
C 2.271128 -0.449767 1.950692
C 2.918030 0.924614 1.698952
C 2.204002 1.655181 0.634088
C -5.992996 -0.334381 0.122060
C 1.697878 -1.910163 -1.532675
C 3.279497 -2.396326 0.717433
C 1.753520 3.419673 -0.656991
C 2.615911 -2.963126 -1.540230
C 3.402429 -3.210228 -0.412081
C 1.957947 4.808012 -1.084240
H -0.650926 -2.352785 -0.482425
H -1.741019 -1.666667 -1.702458
H -2.134156 1.018791 -1.642795
H -1.313643 1.931685 -0.376698
H -3.061128 -2.692496 0.104520
H -2.187085 -1.759746 1.358296
H -2.605389 0.826663 1.411986
H -3.720480 1.489533 0.181066
H -4.743676 -0.327557 1.922890
H -4.935630 -1.914379 1.161147
H 1.204984 -0.317200 2.236438
H 2.756719 -0.925313 2.825818
H 2.926659 1.521922 2.636159
H 3.986882 0.797285 1.411177
H -6.146873 -0.936027 -0.794281
H -5.911280 0.730925 -0.148477
H 1.094659 -1.705924 -2.417310
H 3.905463 -2.587863 1.587052
H 2.720046 -3.586369 -2.426198
H 4.116047 -4.031767 -0.413797
H 1.769970 5.517978 -0.262042
H 2.992207 4.974478 -1.430409
H 1.281959 5.070138 -1.917400
H -7.228641 0.012491 1.657023


%chk=000211841-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211841

0 1
O 2.606181 3.032734 0.402778
O -7.297970 -0.369587 0.848988
N -3.587591 -0.642732 0.058445
N 0.848931 2.477991 -0.947999
C -0.748093 -0.198678 -0.554109
C -1.394028 -1.570807 -0.693830
C -1.766623 0.927983 -0.634537
C -2.600624 -1.726874 0.266664
C -2.966706 0.679441 0.310363
C 0.598779 -0.010751 -0.333399
C 1.582762 -1.153698 -0.315458
C -4.852143 -0.845953 0.799357
C 1.217715 1.328732 -0.172981
C 2.469577 -1.366660 0.784880
C 2.446767 -0.445322 1.995892
C 3.071921 0.946133 1.692246
C 2.285624 1.671074 0.647222
C -6.046098 -0.159824 0.102401
C 1.681274 -2.008797 -1.445581
C 3.398592 -2.435292 0.729483
C 1.675890 3.447135 -0.590185
C 2.614330 -3.066505 -1.491808
C 3.477038 -3.286745 -0.394763
C 1.761657 4.853864 -1.074314
H -0.676460 -2.385321 -0.502259
H -1.777179 -1.690075 -1.728135
H -2.155573 0.976666 -1.672089
H -1.310777 1.905776 -0.419779
H -3.095721 -2.696687 0.074516
H -2.221643 -1.743426 1.322380
H -2.618649 0.760365 1.374478
H -3.720866 1.471004 0.149578
H -4.782823 -0.481470 1.859910
H -5.068788 -1.928836 0.850247
H 1.407184 -0.294047 2.345704
H 3.009882 -0.906267 2.827297
H 3.100817 1.553896 2.618463
H 4.123269 0.818628 1.364044
H -6.220930 -0.619897 -0.881984
H -5.852939 0.923197 -0.046615
H 1.027414 -1.821138 -2.304477
H 4.068075 -2.600546 1.582990
H 2.670638 -3.707814 -2.378418
H 4.204011 -4.106268 -0.415861
H 1.615667 5.573503 -0.248693
H 2.748341 5.062539 -1.525570
H 0.982313 5.017810 -1.833710
H -7.202725 0.029242 1.751126


