%chk=000207956.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207956

0 1
O -4.411020 -0.277661 -1.025044
N -2.906543 -0.028943 0.733248
N -3.971796 1.865722 -0.374773
C -0.133768 -0.791643 0.025984
C -0.556816 0.681347 0.195108
C -1.342591 -1.644699 -0.406348
C -1.741928 0.798595 1.165157
C -2.525984 -1.466470 0.557174
C 1.007040 -0.924230 -1.005841
C 2.278834 -0.286078 -0.519041
C -3.782970 0.466754 -0.284408
C 2.679629 0.965412 -1.011607
C 3.075822 -0.940636 0.434037
C 3.863417 1.552522 -0.556393
C 4.257456 -0.348713 0.886242
C 4.654497 0.898589 0.393005
H 0.234669 -1.169558 1.011675
H -0.827239 1.116038 -0.786755
H 0.297902 1.279237 0.565419
H -1.063424 -2.712839 -0.456773
H -1.660907 -1.367824 -1.432079
H -1.450392 0.440718 2.180002
H -2.044059 1.858689 1.286681
H -3.414350 -2.028784 0.182668
H -2.284640 -1.865566 1.565766
H 0.692473 -0.486601 -1.974845
H 1.187843 -1.997296 -1.224518
H 2.070270 1.480464 -1.751208
H 2.774017 -1.911745 0.820331
H -4.782146 2.162131 -0.907244
H -3.755475 2.462065 0.407884
H 4.170446 2.522488 -0.944274
H 4.872216 -0.861336 1.624376
H 5.575718 1.356653 0.745294


%chk=000207956-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207956

0 1
O -5.070886 -0.394619 -0.313337
N -2.865776 0.040271 0.348767
N -4.523194 1.762736 0.329798
C -0.080911 -0.772270 -0.138946
C -0.500340 0.715566 -0.075440
C -1.281298 -1.622350 -0.622827
C -1.767052 0.918412 0.791679
C -2.524066 -1.395298 0.262825
C 1.169244 -0.992484 -1.040337
C 2.434972 -0.337529 -0.504146
C -4.188612 0.424037 0.105375
C 2.986201 0.820764 -1.109628
C 3.086155 -0.872058 0.639591
C 4.151163 1.430884 -0.588418
C 4.249051 -0.267410 1.164937
C 4.786381 0.889591 0.552495
H 0.179059 -1.100814 0.892032
H -0.708858 1.075350 -1.103470
H 0.322460 1.331353 0.334472
H -1.018245 -2.698743 -0.606992
H -1.526455 -1.356722 -1.670516
H -1.520322 0.703644 1.855483
H -2.067045 1.977865 0.731599
H -3.409214 -1.916376 -0.134934
H -2.323558 -1.784692 1.285847
H 0.943993 -0.610984 -2.055854
H 1.328618 -2.085643 -1.138272
H 2.502621 1.243441 -1.999422
H 2.682541 -1.775371 1.115198
H -5.486137 2.010819 0.119111
H -3.918169 2.452165 0.765164
H 4.563188 2.323199 -1.073696
H 4.739947 -0.698819 2.044932
H 5.690743 1.358889 0.955831


