%chk=000213300.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213300

0 1
O 0.117049 2.351738 0.177994
N -3.715438 0.593927 -0.266590
N 1.179446 0.335902 0.338485
C -4.352987 0.271157 1.053178
C -4.672990 1.325453 -1.161896
C -5.591748 -0.613082 0.833048
C -5.917874 0.458141 -1.413682
C -6.600652 0.074567 -0.095101
C -2.459434 1.388331 -0.074371
C -1.306556 0.405532 0.201610
C 0.012680 1.140262 0.232603
C 2.501047 0.922654 0.218696
C 1.094880 -1.106173 0.444975
C 3.325334 -0.662569 -1.684710
C 1.917006 -1.224310 -1.916970
C 3.470386 0.466795 -0.697443
C 1.418563 -1.900493 -0.675236
C 2.784114 2.003369 1.081804
C 0.690174 -1.691991 1.652958
C 4.727003 1.108261 -0.696425
C 1.303744 -3.291337 -0.573204
C 4.028914 2.623208 1.050841
C 0.581593 -3.082755 1.733843
C 5.008833 2.168615 0.160467
C 0.880539 -3.878356 0.623553
H -4.635034 1.180721 1.626469
H -3.607243 -0.280531 1.664985
H -4.155194 1.517111 -2.127034
H -4.976271 2.312212 -0.750770
H -6.057997 -0.850059 1.805956
H -5.277975 -1.579417 0.389520
H -5.619616 -0.460285 -1.958373
H -6.620777 0.999544 -2.071884
H -7.457906 -0.595486 -0.290322
H -7.018023 0.974495 0.394508
H -2.521744 2.139482 0.742615
H -2.228282 1.965256 -0.998362
H -1.478551 -0.135076 1.154619
H -1.307121 -0.389599 -0.577983
H 3.726771 -0.326539 -2.666947
H 3.991297 -1.493130 -1.355819
H 1.936988 -1.925656 -2.775091
H 1.224741 -0.408944 -2.219590
H 2.008140 2.367508 1.758502
H 0.473682 -1.069423 2.519820
H 5.497207 0.769128 -1.389135
H 1.546275 -3.920301 -1.428495
H 4.237690 3.459682 1.715368
H 0.266656 -3.546545 2.667480
H 5.986130 2.646468 0.135141
H 0.789433 -4.961459 0.691596


%chk=000213300-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213300

0 1
O 0.103457 2.409518 0.023600
N -3.753765 0.622494 -0.344754
N 1.182983 0.352673 0.308132
C -4.328165 0.078296 0.912691
C -4.748727 1.459838 -1.066941
C -5.586946 -0.769452 0.635287
C -6.015928 0.652810 -1.411919
C -6.645292 0.052536 -0.134581
C -2.485486 1.362935 -0.125621
C -1.317327 0.418246 0.217285
C 0.025782 1.156190 0.184500
C 2.509175 0.942325 0.202535
C 1.102788 -1.084989 0.490969
C 3.269648 -0.646825 -1.764491
C 1.854767 -1.267889 -1.904805
C 3.475022 0.465437 -0.728804
C 1.406821 -1.922086 -0.614236
C 2.825007 2.010528 1.080497
C 0.753033 -1.632482 1.744378
C 4.758019 1.078486 -0.714011
C 1.334780 -3.324263 -0.440161
C 4.096510 2.612357 1.060214
C 0.679121 -3.034439 1.902681
C 5.077002 2.136003 0.158618
C 0.966537 -3.881022 0.806611
H -4.593307 0.909751 1.621749
H -3.566285 -0.546900 1.412984
H -4.274338 1.835681 -1.992811
H -5.041851 2.356283 -0.456402
H -5.999124 -1.138293 1.594638
H -5.295015 -1.651894 0.033478
H -5.739710 -0.163273 -2.107651
H -6.738711 1.309659 -1.933551
H -7.519053 -0.577342 -0.388255
H -7.014783 0.874807 0.513324
H -2.583278 2.143932 0.668415
H -2.235851 1.901858 -1.056846
H -1.456469 -0.041998 1.213392
H -1.311613 -0.423236 -0.502577
H 3.570076 -0.243509 -2.751827
H 3.983807 -1.464975 -1.538054
H 1.880361 -2.012133 -2.721633
H 1.138799 -0.477842 -2.202281
H 2.053686 2.369586 1.766689
H 0.555333 -0.961686 2.587888
H 5.515222 0.715579 -1.421050
H 1.565930 -3.982139 -1.286580
H 4.320864 3.439923 1.741618
H 0.408437 -3.461913 2.874221
H 6.074782 2.587608 0.133459
H 0.910175 -4.968760 0.925189


