%chk=000261792.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261792

0 1
O 3.521891 -1.441130 -0.903271
O -3.325267 3.183974 -0.033150
O -4.801429 0.658407 -0.223927
O -1.291553 -5.332770 -0.044458
N 2.963070 1.870097 0.621737
C 3.649070 0.905940 -0.297212
C 5.145952 1.139101 -0.020624
C 3.073620 -0.476145 0.077560
C 3.801953 3.111021 0.653524
C 5.241653 2.636964 0.346266
C 1.544872 2.055002 0.210356
C 1.550629 -0.475621 0.038541
C 0.859776 0.707953 0.082874
C 0.845563 -1.746185 0.010655
C -0.594449 0.724494 0.016335
C -0.572885 -1.758389 -0.026867
C -1.304570 -0.497868 -0.038607
C -1.319641 1.946838 -0.020118
C 1.536827 -2.990699 0.036418
C -2.724110 -0.483829 -0.087761
C -1.267030 -2.991800 -0.046994
C -2.701432 1.946394 -0.085324
C 0.866736 -4.196987 0.021526
C -3.415965 0.711090 -0.104282
C -0.547408 -4.175997 -0.024346
C -4.226966 3.455718 -1.142002
C -5.499568 1.125498 0.964435
H 3.436380 1.094488 -1.381609
H 5.769375 0.894512 -0.893514
H 5.501363 0.514710 0.818212
H 3.428912 -0.818270 1.077629
H 3.718722 3.536648 1.674804
H 3.476467 3.891781 -0.060421
H 5.900124 2.784114 1.218499
H 5.678366 3.220160 -0.480925
H 1.426395 2.620963 -0.742466
H 1.052443 2.649970 1.017608
H 4.472407 -1.322414 -1.089364
H -0.806061 2.907346 0.001694
H 2.633226 -2.996463 0.058508
H -3.281768 -1.424566 -0.113805
H -2.355851 -3.023036 -0.081681
H 1.406167 -5.137832 0.039317
H -0.722136 -6.139505 -0.036838
H -4.711601 4.384232 -0.822714
H -4.951904 2.642760 -1.269459
H -3.636117 3.604436 -2.049910
H -6.547493 1.079562 0.650071
H -5.193971 2.148258 1.211047
H -5.303183 0.440470 1.793734


%chk=000261792-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000261792

0 1
O 3.549741 -1.327028 -1.244110
O -3.404910 3.196514 -0.075410
O -4.875821 0.661845 -0.071556
O -1.255793 -5.449959 0.089895
N 2.958263 1.893722 0.561912
C 3.655473 0.954742 -0.337695
C 5.159043 1.157165 0.003559
C 3.095816 -0.459809 -0.120863
C 3.785230 3.117812 0.601668
C 5.226063 2.556212 0.711118
C 1.550906 2.060913 0.187935
C 1.566314 -0.479393 -0.074113
C 0.851411 0.714590 0.022045
C 0.862389 -1.758825 -0.063301
C -0.604576 0.707483 -0.003215
C -0.580926 -1.796090 -0.029651
C -1.327449 -0.538048 -0.037005
C -1.346104 1.930281 -0.026520
C 1.569658 -3.003220 -0.043839
C -2.752895 -0.498785 -0.046999
C -1.245062 -3.055243 0.016317
C -2.742563 1.946184 -0.065122
C 0.903035 -4.230476 0.012850
C -3.461347 0.705980 -0.042254
C -0.519340 -4.250705 0.038896
C -4.223154 3.449790 -1.285487
C -5.530379 1.239492 1.126441
H 3.476495 1.217926 -1.413979
H 5.785407 1.130004 -0.905583
H 5.515422 0.362850 0.685723
H 3.500647 -0.862971 0.834913
H 3.503861 3.759360 1.455805
H 3.672530 3.721564 -0.336144
H 5.503537 2.432684 1.771476
H 5.963388 3.230960 0.243201
H 1.447544 2.655348 -0.762098
H 1.043091 2.639754 0.982530
H 4.534820 -1.231990 -1.312907
H -0.841231 2.899578 -0.044643
H 2.658212 -2.989080 -0.110574
H -3.347046 -1.415982 -0.049455
H -2.334475 -3.126373 0.041380
H 1.473254 -5.168552 0.027761
H -0.650078 -6.231779 0.093960
H -4.711824 4.420460 -1.110760
H -4.976617 2.654453 -1.427027
H -3.570268 3.511344 -2.176896
H -6.611297 1.179538 0.927709
H -5.220783 2.289318 1.278256
H -5.278011 0.639837 2.021557


