%chk=000295734.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295734

0 1
O -3.664718 0.874208 0.649012
O -1.737525 1.995613 0.267409
N 0.519083 0.468609 -0.046034
N 0.214412 -1.886870 0.204718
N -1.994350 -2.796605 0.645818
C 1.948511 0.417907 -0.227688
C 2.731256 1.443064 0.363263
C -0.310966 -0.597298 0.186143
C -1.717195 -0.399500 0.408213
C 2.547597 -0.578389 -1.012228
C 4.113698 1.437666 0.138657
C 2.113364 2.508194 1.207647
C 3.930032 -0.562946 -1.212868
C 4.711556 0.443276 -0.641325
C -2.507126 -1.556264 0.627404
C -0.623615 -2.923429 0.434604
C -2.311334 0.926561 0.419065
C -0.056790 -4.299023 0.461829
C -4.404540 2.140124 0.652640
C -4.648522 2.592460 -0.770809
H 0.096335 1.423686 -0.019983
H 1.941040 -1.370482 -1.456317
H 4.732841 2.216771 0.581923
H 1.439569 3.154012 0.623979
H 1.525901 2.080518 2.034600
H 2.862640 3.169070 1.664562
H 4.394528 -1.339857 -1.818045
H 5.788512 0.454787 -0.800557
H -3.592517 -1.454713 0.794620
H -0.289968 -4.801657 1.415931
H -0.497866 -4.921579 -0.334653
H 1.037589 -4.303210 0.332859
H -5.325998 1.832542 1.180292
H -3.835265 2.878671 1.244741
H -5.332304 3.448610 -0.808776
H -3.709393 2.897839 -1.257063
H -5.082072 1.789835 -1.381683


%chk=000295734-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000295734

0 1
O -3.611524 0.841201 0.779356
O -1.527691 1.871866 0.601577
N 0.604404 0.254291 0.215251
N 0.168101 -2.091434 0.070213
N -2.102998 -2.959775 0.270967
C 2.017190 0.301719 0.040501
C 2.614364 1.606438 0.063519
C -0.278961 -0.796927 0.232903
C -1.698403 -0.546786 0.424578
C 2.824970 -0.851478 -0.148403
C 4.013752 1.704565 -0.108469
C 1.777920 2.859175 0.266207
C 4.218478 -0.715263 -0.316222
C 4.822468 0.561069 -0.298411
C -2.543674 -1.683497 0.430616
C -0.739022 -3.101559 0.094518
C -2.234772 0.811558 0.600423
C -0.232514 -4.508412 -0.086041
C -4.242543 2.189930 0.940785
C -4.559109 2.808206 -0.423479
H 0.124355 1.163940 0.351923
H 2.342319 -1.828901 -0.160391
H 4.474692 2.699458 -0.092738
H 1.014871 2.987791 -0.526359
H 1.236000 2.850987 1.232206
H 2.419313 3.755686 0.255625
H 4.830063 -1.612876 -0.461147
H 5.904740 0.668192 -0.429010
H -3.620220 -1.547375 0.570186
H -0.544860 -5.134809 0.768369
H -0.683984 -4.958444 -0.988865
H 0.863293 -4.518534 -0.177242
H -5.154102 1.975054 1.520561
H -3.558526 2.829084 1.525356
H -5.104956 3.759153 -0.279644
H -3.633579 3.024424 -0.982563
H -5.193454 2.134486 -1.024753


