%chk=000270519.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270519

0 1
O -3.534670 -1.425987 0.946588
O -3.465027 0.748719 0.125635
O 3.620345 -1.445802 0.524266
O 4.544274 0.776108 -1.149741
N -1.469848 -0.255029 0.653849
C -0.637308 0.856541 1.214578
C 0.738007 0.813944 0.594611
C -2.877454 -0.184361 1.056227
C 1.551752 -0.311492 0.787841
C 1.199867 1.894382 -0.171377
C 2.832766 -0.339460 0.229003
C 3.308820 0.765053 -0.513709
C 2.484970 1.877701 -0.718705
C -3.473707 -2.126535 -0.331172
C -4.890754 0.984172 0.261778
C -4.653497 -3.080223 -0.288723
C -5.297621 1.659440 -1.035127
C 4.018003 -2.215109 -0.644687
C 5.677114 0.700161 -0.240047
H -1.111068 1.854376 1.065919
H -0.555009 0.701384 2.316970
H -3.057304 0.103499 2.113317
H -1.371120 -0.295457 -0.369143
H 1.192667 -1.169387 1.359912
H 0.559082 2.758988 -0.340189
H 2.858801 2.715348 -1.306130
H -2.503275 -2.651869 -0.361550
H -3.546253 -1.390530 -1.150315
H -5.034748 1.633704 1.142244
H -5.399428 0.015182 0.416918
H -5.608525 -2.541125 -0.300980
H -4.639428 -3.674979 0.636158
H -4.638609 -3.772501 -1.137019
H -6.352636 1.951712 -1.021796
H -4.694425 2.559749 -1.215319
H -5.134645 0.997414 -1.895269
H 4.710450 -2.946675 -0.215414
H 3.136170 -2.703243 -1.068540
H 4.511594 -1.572966 -1.383048
H 5.586218 -0.168364 0.422524
H 5.740282 1.629935 0.331504
H 6.521276 0.597281 -0.929644


%chk=000270519-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270519

0 1
O -3.413714 -1.404638 0.871266
O -3.741108 0.779986 -0.097399
O 3.399379 -1.568383 0.451097
O 4.871384 0.633383 -0.792670
N -1.532830 -0.021854 0.190163
C -0.742240 1.195578 0.488861
C 0.726863 1.019523 0.123799
C -2.858969 -0.068009 0.746555
C 1.403368 -0.189664 0.418407
C 1.442746 2.069906 -0.500780
C 2.770245 -0.343954 0.114966
C 3.497090 0.736799 -0.466966
C 2.819528 1.931595 -0.786054
C -3.341986 -2.232326 -0.353717
C -5.099748 0.966891 0.458248
C -4.189104 -3.478797 -0.100206
C -5.839779 1.938096 -0.461331
C 3.911686 -2.334399 -0.708451
C 5.768076 0.448058 0.372419
H -1.144771 2.098614 -0.020648
H -0.834185 1.379423 1.578872
H -2.854965 0.313872 1.786845
H -1.516198 -0.255540 -0.810569
H 0.859351 -1.025750 0.868889
H 0.927149 3.002939 -0.757388
H 3.390582 2.739984 -1.253993
H -2.283840 -2.506111 -0.543203
H -3.727305 -1.651237 -1.216896
H -5.019832 1.374028 1.490422
H -5.613658 -0.012507 0.517058
H -5.242779 -3.205310 0.082489
H -3.815830 -4.023590 0.784094
H -4.147571 -4.156757 -0.972586
H -6.865227 2.116692 -0.088347
H -5.311795 2.906131 -0.512350
H -5.906859 1.528025 -1.484113
H 4.405291 -3.220101 -0.279990
H 3.071395 -2.649283 -1.356300
H 4.631299 -1.734128 -1.294162
H 5.490782 -0.454293 0.946488
H 5.725027 1.337598 1.029390
H 6.779155 0.343207 -0.050009


