%chk=000270940.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270940

0 1
O 3.774448 1.844005 0.179271
O 2.883633 -1.869030 -1.238839
O -4.374150 -0.849883 0.384122
O -3.030050 0.545024 -0.786083
N 1.208654 -0.234255 1.529538
N -0.116179 -0.561025 1.478244
C 3.512420 -0.390177 0.874226
C 2.050219 -0.663633 0.635387
C 4.128985 0.492401 -0.212110
C 1.655387 -1.418010 -0.619614
C -2.460776 -0.148785 1.505866
C -1.040605 0.343753 1.331304
C -0.876626 1.788629 0.996887
C -3.253327 -0.066844 0.231557
C -5.337464 -0.901645 -0.716601
C 4.239785 2.844267 -0.741428
C 2.660513 -2.786538 -2.325979
C -6.178281 0.357366 -0.725505
H 4.050832 -1.363208 0.911470
H 3.658777 0.101547 1.865547
H 3.723775 0.276544 -1.217385
H 5.228887 0.403087 -0.226434
H 1.020160 -2.290575 -0.368947
H 1.119526 -0.760964 -1.330876
H -2.477032 -1.200082 1.892445
H -2.970731 0.442231 2.301120
H 0.181159 2.093281 0.939973
H -1.338244 2.016285 0.019010
H -1.350567 2.439480 1.742998
H -4.783542 -1.051089 -1.660332
H -5.909407 -1.808221 -0.445734
H 5.331845 2.837035 -0.802367
H 3.787913 2.703642 -1.727518
H 3.885495 3.775936 -0.283073
H 3.681488 -3.007867 -2.661345
H 2.084836 -2.308840 -3.123852
H 2.166291 -3.695278 -1.969469
H -6.608300 0.563336 0.263099
H -5.578208 1.235102 -1.009345
H -7.006438 0.281498 -1.440231


%chk=000270940-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270940

0 1
O 3.183226 1.905825 -0.149510
O 2.955758 -2.107850 -1.054972
O -4.474702 -0.649037 0.440039
O -2.631656 -0.086156 -0.877707
N 1.343149 -0.357213 1.713900
N 0.035422 -0.862311 1.607629
C 3.631494 -0.230776 0.925058
C 2.199458 -0.689198 0.773301
C 4.069246 0.734370 -0.190373
C 1.777754 -1.476485 -0.455061
C -2.351273 -0.583990 1.542146
C -0.953040 0.000243 1.506274
C -0.788188 1.495201 1.344286
C -3.116521 -0.393698 0.235312
C -5.365575 -0.543856 -0.759154
C 3.538158 2.895128 -1.162292
C 2.601818 -2.913620 -2.221844
C -5.836592 0.899380 -0.957975
H 4.304574 -1.108077 0.885917
H 3.734823 0.259833 1.907638
H 4.003571 0.234400 -1.179809
H 5.123733 1.048054 -0.021007
H 1.020889 -2.233493 -0.147497
H 1.284431 -0.801040 -1.192330
H -2.281856 -1.669185 1.743098
H -2.952448 -0.141785 2.359302
H 0.230941 1.805272 1.629360
H -0.949922 1.779635 0.286818
H -1.532992 2.042326 1.950955
H -4.811639 -0.910913 -1.641108
H -6.199155 -1.223698 -0.521294
H 4.568455 3.284796 -1.010620
H 3.467778 2.475251 -2.189465
H 2.817787 3.721823 -1.056029
H 3.544218 -3.337916 -2.602440
H 2.126504 -2.296625 -3.014309
H 1.908997 -3.737968 -1.950366
H -6.337734 1.278816 -0.050816
H -4.986350 1.558585 -1.200594
H -6.557443 0.944452 -1.795460


