%chk=000207566.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207566

0 1
O 0.394898 -0.612595 0.310754
O 4.607126 1.473556 0.652286
O 2.346727 -1.960499 -1.443876
N 1.750128 -0.697318 0.511811
N 3.766710 -0.307705 -0.585035
C 2.362576 0.540720 1.106816
C -0.060018 0.194433 -0.845270
C -1.525957 0.379396 -0.579431
C 3.720254 0.696115 0.429282
C 2.572334 -1.099273 -0.640341
C -2.281121 -0.692209 -0.091125
C -3.655376 -0.531350 0.150807
C -2.132652 1.618688 -0.833916
C -4.262552 0.706268 -0.111283
C -3.501436 1.771187 -0.602035
C -4.452142 -1.678790 0.678783
H 2.479085 0.369225 2.204561
H 1.728080 1.445822 1.006885
H 0.121522 -0.407958 -1.756663
H 0.497169 1.141364 -0.897786
H -1.793885 -1.647753 0.110885
H 4.575364 -0.482013 -1.178593
H -1.549858 2.454248 -1.211872
H -5.327298 0.840329 0.067374
H -3.980179 2.729110 -0.803259
H -4.426674 -2.533480 -0.013427
H -4.052300 -2.032286 1.640936
H -5.507924 -1.427633 0.841832


%chk=000207566-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207566

0 1
O 0.516632 0.454135 0.252737
O 5.325640 0.323549 0.942212
O 1.619566 -2.064105 -0.755632
N 1.902510 0.219863 -0.088983
N 3.699300 -1.128675 -0.001749
C 2.921939 0.986817 0.649031
C -0.272085 0.789053 -1.001092
C -1.725610 0.701765 -0.614354
C 4.158916 0.064079 0.574248
C 2.303167 -1.110125 -0.325502
C -2.299015 -0.566386 -0.341774
C -3.660163 -0.693831 0.023926
C -2.526365 1.865271 -0.522586
C -4.450208 0.484826 0.098906
C -3.890089 1.752803 -0.170201
C -4.258319 -2.051741 0.348307
H 2.624746 1.144045 1.703312
H 3.137903 1.964426 0.187479
H 0.002744 0.038816 -1.763025
H 0.018066 1.800991 -1.338693
H -1.664830 -1.459281 -0.410368
H 4.287692 -1.942139 -0.187966
H -2.088445 2.849676 -0.727437
H -5.510404 0.405450 0.369670
H -4.515349 2.650379 -0.107474
H -3.713857 -2.866312 -0.159913
H -4.211259 -2.254247 1.435987
H -5.320224 -2.109499 0.050034


