%chk=000281828.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281828

0 1
O 2.282508 -2.291505 -1.680259
O -0.561826 -3.612380 -0.209115
O 0.193308 3.338739 -1.022157
O -3.365496 -0.481888 0.877666
O 5.445295 1.409692 -0.166022
O 1.327074 -4.094153 1.164699
N 0.956855 0.501495 -0.529609
N 3.832413 0.014384 0.764022
N -4.276719 2.171566 0.405261
N 0.729195 -5.421184 -0.706660
C 3.200329 -0.242886 -0.541531
C 2.250342 -1.487322 -0.434265
C 0.908120 -0.858050 -0.181034
C 2.291601 0.950146 -0.990035
C -0.401614 -1.172057 0.231872
C -0.274569 1.077979 -0.350509
C -1.146503 0.064464 0.122260
C -0.661652 2.477424 -0.588716
C -0.928227 -2.497824 0.712250
C -2.539221 0.378917 0.420992
C -2.061869 2.798051 -0.307327
C -2.963106 1.821004 0.159665
C 4.951227 0.833662 0.862816
C -2.509881 4.224632 -0.542781
C 5.535694 0.997914 2.262049
C -5.415460 1.349008 0.876072
C 0.577748 -4.363290 0.163373
C -6.676675 2.227164 0.946968
H 3.994445 -0.424204 -1.283074
H 2.571125 -2.191682 0.349183
H 2.575747 1.904699 -0.525798
H 2.288198 1.090038 -2.085257
H 3.448338 -0.431723 1.598800
H -0.532044 -2.745788 1.714638
H -2.027065 -2.486017 0.733072
H 1.533373 -2.006403 -2.263872
H -3.308966 4.293904 -1.309986
H -2.885582 4.706473 0.383879
H -1.649709 4.812705 -0.901272
H -4.502836 3.153262 0.227685
H 6.603302 0.720536 2.238849
H 5.025192 0.390074 3.028922
H 5.481268 2.060862 2.554811
H -5.184579 0.912806 1.864194
H -5.570388 0.493896 0.194389
H -6.545506 3.067524 1.654447
H -6.939762 2.639487 -0.045204
H -7.532545 1.625688 1.297726
H 1.556686 -6.003859 -0.622598
H 0.092415 -5.536977 -1.490677


%chk=000281828-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000281828

0 1
O 2.282351 -2.294639 -1.674889
O -0.563291 -3.612376 -0.204093
O 0.187739 3.338486 -1.024340
O -3.367671 -0.483290 0.879754
O 5.446307 1.393274 -0.161323
O 1.316663 -4.081623 1.148439
N 0.953780 0.502533 -0.529514
N 3.830778 0.017956 0.765799
N -4.281140 2.169108 0.404400
N 0.737355 -5.408779 -0.699143
C 3.198361 -0.239377 -0.539456
C 2.249345 -1.485193 -0.432899
C 0.906305 -0.856919 -0.180316
C 2.288623 0.953236 -0.987632
C -0.402900 -1.171546 0.232880
C -0.278338 1.078116 -0.350960
C -1.149140 0.064135 0.122675
C -0.666506 2.476982 -0.590201
C -0.927658 -2.496804 0.716225
C -2.542065 0.377769 0.421710
C -2.066881 2.796799 -0.308873
C -2.967225 1.819366 0.159089
C 4.953541 0.827521 0.862788
C -2.516098 4.222794 -0.545570
C 5.547392 0.983123 2.258098
C -5.419266 1.346291 0.876284
C 0.579046 -4.353646 0.164315
C -6.681064 2.223686 0.946333
H 3.993433 -0.419103 -1.280390
H 2.569915 -2.189561 0.350427
H 2.571085 1.907295 -0.521284
H 2.286612 1.095729 -2.082580
H 3.440939 -0.420012 1.602354
H -0.528753 -2.742874 1.718037
H -2.026488 -2.485422 0.739930
H 1.569302 -1.973766 -2.284791
H -3.315274 4.290705 -1.312803
H -2.892172 4.705159 0.380662
H -1.656429 4.811258 -0.904628
H -4.508012 3.150461 0.225869
H 6.583925 0.603681 2.251623
H 4.979647 0.452458 3.041842
H 5.594455 2.055556 2.513140
H -5.187983 0.911365 1.864869
H -5.573699 0.490303 0.195593
H -6.550275 3.065070 1.652662
H -6.944688 2.634513 -0.046317
H -7.536433 1.622098 1.298117
H 1.570271 -5.984167 -0.614739
H 0.102276 -5.528726 -1.484371


