%chk=000237647.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237647

0 1
O 5.630327 1.587567 -0.326849
O -5.461089 0.575310 -0.146435
N 0.955980 0.146755 -0.075785
C 2.357103 -0.209669 0.366556
C 3.310199 0.881812 -0.172690
C 2.785742 -1.582531 -0.201356
C 4.766996 0.561749 0.185859
C 4.247022 -1.896537 0.148035
C 5.198586 -0.808656 -0.357971
C 0.484441 1.401699 0.597563
C -0.015393 -0.973563 0.161410
C -0.809805 1.860148 -0.090016
C -1.465735 -0.563227 0.080072
C -1.857881 0.788859 -0.033149
C -2.444832 -1.562269 0.119036
C -3.209544 1.125540 -0.106684
C -4.169795 0.097288 -0.065476
C -3.806092 -1.249121 0.048752
C -6.540635 -0.388147 -0.121817
H 2.434220 -0.244448 1.484486
H 3.185455 0.967526 -1.270110
H 3.039173 1.878509 0.228746
H 2.648179 -1.584117 -1.301119
H 2.141434 -2.390140 0.190783
H 4.949120 0.642738 1.281973
H 4.357448 -2.013327 1.243941
H 4.530386 -2.873258 -0.289589
H 6.239233 -1.022515 -0.049879
H 5.210563 -0.794438 -1.463832
H 1.264506 2.187852 0.482777
H 0.312838 1.270648 1.687729
H 0.152778 -1.478930 1.141025
H 0.180389 -1.724007 -0.643020
H -0.600998 2.092884 -1.159448
H -1.166916 2.802823 0.367195
H 5.568169 1.655354 -1.297352
H -2.150754 -2.608540 0.204514
H -3.538360 2.157462 -0.197223
H -4.545762 -2.039615 0.080947
H -7.422519 0.260528 -0.202940
H -6.541626 -0.933962 0.825827
H -6.469352 -1.061234 -0.980886


%chk=000237647-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000237647

0 1
O 5.703786 1.595346 -0.549972
O -5.537294 0.572075 -0.269695
N 0.953024 0.174232 0.059946
C 2.377848 -0.173163 0.379109
C 3.341123 0.867525 -0.255704
C 2.765440 -1.587677 -0.125100
C 4.826122 0.551695 0.020251
C 4.255497 -1.907161 0.144520
C 5.199830 -0.854791 -0.480399
C 0.499846 1.419283 0.740682
C -0.000497 -0.925426 0.363221
C -0.807890 1.922612 0.105942
C -1.461624 -0.530295 0.170087
C -1.863126 0.829463 0.068232
C -2.451130 -1.537732 0.117777
C -3.230464 1.147374 -0.076236
C -4.209464 0.128578 -0.125282
C -3.821731 -1.231000 -0.028845
C -6.584003 -0.448862 -0.323845
H 2.530547 -0.164022 1.494146
H 3.158857 0.869238 -1.351009
H 3.141191 1.889014 0.112216
H 2.558196 -1.642201 -1.213546
H 2.149786 -2.360951 0.368174
H 5.029814 0.623575 1.105078
H 4.428255 -1.945188 1.240137
H 4.494798 -2.913696 -0.247668
H 6.255780 -1.070223 -0.233490
H 5.105124 -0.881901 -1.587257
H 1.274063 2.196010 0.637076
H 0.348386 1.244718 1.837838
H 0.132513 -1.290074 1.419446
H 0.216681 -1.781407 -0.298660
H -0.589073 2.259209 -0.926310
H -1.184419 2.801598 0.663979
H 5.580928 1.596827 -1.534255
H -2.149877 -2.590755 0.191497
H -3.558749 2.189930 -0.151759
H -4.558581 -2.038707 -0.067805
H -7.525757 0.109432 -0.431676
H -6.612083 -1.050072 0.606384
H -6.448471 -1.121630 -1.193626


