%chk=000212767.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212767

0 1
O 0.085809 0.371897 1.619300
O -0.543434 -0.227318 -1.826480
N -4.649133 -1.292022 0.420671
C 0.495919 0.472489 0.238432
C -1.666935 -0.957756 0.162490
C -0.599124 -0.249184 -0.617674
C -2.501182 -1.898655 -0.710324
C 0.710770 1.933801 -0.119248
C 1.796076 -0.308401 0.134452
C -3.739250 -2.423476 0.035423
C 0.446473 2.439950 -1.396952
C 2.369825 -0.529869 -1.126536
C 1.227520 2.786718 0.870771
C 2.427162 -0.792046 1.287508
C -5.662342 -1.763033 1.413385
C -5.333572 -0.717068 -0.775602
C 0.669970 3.792714 -1.674116
C 3.572010 -1.232743 -1.228520
C 1.448329 4.136016 0.590954
C 3.629973 -1.496128 1.178429
C 1.165726 4.643137 -0.682545
C 4.203903 -1.716130 -0.077256
H -1.216829 -1.503592 1.021293
H -2.341709 -0.206418 0.639832
H -1.882438 -2.755365 -1.042314
H -2.801370 -1.371594 -1.641043
H -3.414557 -2.936245 0.967863
H -4.244711 -3.192315 -0.587865
H 0.071322 1.782720 -2.188564
H 1.870182 -0.158566 -2.024960
H 1.468225 2.383923 1.856514
H 1.973833 -0.617092 2.265865
H -0.582454 1.060217 1.830184
H -5.142501 -2.106126 2.322017
H -6.317730 -2.572318 1.060663
H -6.296487 -0.911705 1.708700
H -5.994907 -1.413223 -1.311051
H -4.571831 -0.350950 -1.484547
H -5.928689 0.154934 -0.461777
H 0.458508 4.180259 -2.669689
H 4.017111 -1.404071 -2.207119
H 1.847189 4.792469 1.362426
H 4.119461 -1.872048 2.074892
H 1.337708 5.695570 -0.900651
H 5.141181 -2.262855 -0.160032


%chk=000212767-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212767

0 1
O -0.025126 0.821686 1.763206
O -0.772631 0.284982 -1.759517
N -4.558176 -1.599499 0.217738
C 0.410963 0.763895 0.343298
C -1.646412 -0.870788 0.206057
C -0.706905 0.074151 -0.517782
C -2.236942 -1.969659 -0.699807
C 0.755988 2.189894 -0.115756
C 1.603445 -0.208684 0.286344
C -3.499446 -2.599236 -0.073452
C -0.216717 3.031996 -0.714750
C 2.256897 -0.436833 -0.952195
C 2.030969 2.730547 0.192100
C 2.040635 -0.894719 1.443867
C -5.586412 -2.126521 1.138708
C -5.160948 -1.018367 -1.000431
C 0.082543 4.382779 -1.001093
C 3.344281 -1.332291 -1.026139
C 2.330384 4.079220 -0.094656
C 3.131379 -1.791546 1.365775
C 1.356002 4.912077 -0.692569
C 3.786889 -2.013283 0.133396
H -1.141334 -1.283547 1.097134
H -2.500893 -0.277401 0.606188
H -1.487652 -2.767714 -0.865635
H -2.457063 -1.542705 -1.694906
H -3.226821 -3.077611 0.887799
H -3.878026 -3.411632 -0.746358
H -1.198063 2.631598 -0.986910
H 1.906814 0.084790 -1.850192
H 2.786742 2.089379 0.658177
H 1.532307 -0.705611 2.392867
H -0.563426 1.645033 1.881796
H -5.109191 -2.471242 2.073441
H -6.167642 -2.982633 0.710659
H -6.303134 -1.325302 1.394624
H -5.675641 -1.781746 -1.638001
H -4.388993 -0.525456 -1.614803
H -5.904973 -0.253794 -0.713597
H -0.675402 5.018007 -1.472941
H 3.844989 -1.499904 -1.986278
H 3.320777 4.480265 0.148012
H 3.468998 -2.314108 2.268133
H 1.588070 5.958775 -0.919366
H 4.631896 -2.708738 0.075015


