%chk=000198149.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198149

0 1
O 0.930065 0.367548 -1.630840
O 5.676554 0.705208 0.287124
N 2.168405 -1.722779 -0.035575
N -3.776189 -0.778192 0.090689
C 0.759194 0.393810 -0.195394
C 0.808758 -1.132535 0.217465
C 1.906952 1.188684 0.453446
C 3.237424 0.510011 0.102210
C -0.267681 -1.939750 -0.567901
C -0.614174 0.963568 0.155274
C 3.244846 -0.930135 0.646499
C -1.669952 0.040118 0.049233
C -1.602905 -1.356252 -0.288361
C 4.426488 1.306334 0.659017
C -3.030860 0.391530 0.290719
C 2.240140 -3.138586 0.443170
C -0.942595 2.256362 0.519086
C -2.898955 -1.840444 -0.260479
C -3.350579 1.718558 0.658679
C -2.300710 2.614530 0.766421
C 0.663311 1.594296 -2.333734
C -5.230654 -0.893228 0.219693
H 0.547907 -1.164969 1.309715
H 1.760847 1.241848 1.547777
H 1.897673 2.232432 0.089455
H 3.312611 0.456575 -1.017969
H -0.221695 -3.013993 -0.312933
H -0.037222 -1.861265 -1.657359
H 4.224414 -1.403870 0.407540
H 3.154897 -0.928190 1.753186
H 4.473629 1.295011 1.763795
H 4.422143 2.352205 0.304075
H 3.236903 -3.543331 0.203703
H 1.509074 -3.748327 -0.113919
H 2.057330 -3.274621 1.518947
H -0.180897 3.023299 0.622781
H -3.268069 -2.828123 -0.457990
H -4.375873 2.013606 0.847851
H -2.507532 3.646188 1.051335
H -0.398708 1.851699 -2.262201
H 0.929118 1.329745 -3.364481
H 1.293819 2.406123 -1.964426
H -5.555471 -0.633113 1.244187
H -5.742090 -0.213848 -0.487317
H -5.568460 -1.921523 0.006622
H 5.711869 0.558484 -0.679213


%chk=000198149-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000198149

0 1
O 0.917626 0.325308 -1.701083
O 5.757142 0.769962 0.359820
N 2.177469 -1.727442 -0.027209
N -3.818725 -0.763027 0.107987
C 0.755634 0.365087 -0.210117
C 0.823353 -1.156795 0.217320
C 1.914934 1.165035 0.424394
C 3.272611 0.504425 0.121850
C -0.282110 -2.003124 -0.493732
C -0.621037 0.935794 0.151708
C 3.245478 -0.944988 0.636502
C -1.695429 0.027955 0.049938
C -1.630384 -1.371142 -0.256995
C 4.434532 1.304971 0.732776
C -3.053615 0.398231 0.283869
C 2.286642 -3.161100 0.313785
C -0.942842 2.260642 0.511382
C -2.944039 -1.834088 -0.212391
C -3.378443 1.730445 0.632138
C -2.302201 2.641690 0.744052
C 0.674626 1.582114 -2.408387
C -5.271301 -0.853146 0.253313
H 0.597979 -1.163222 1.321205
H 1.756173 1.210742 1.521261
H 1.901618 2.210063 0.057088
H 3.393286 0.460540 -0.980616
H -0.269471 -3.039344 -0.113742
H -0.029267 -2.030188 -1.570634
H 4.217413 -1.428902 0.431490
H 3.112779 -0.926036 1.754574
H 4.421475 1.242964 1.835874
H 4.351827 2.375682 0.441782
H 3.339018 -3.473491 0.194477
H 1.680104 -3.778481 -0.368711
H 1.977190 -3.392267 1.365974
H -0.160291 3.019757 0.618990
H -3.347245 -2.832981 -0.374421
H -4.407585 2.057698 0.815620
H -2.517655 3.680913 1.018303
H -0.365368 1.939031 -2.276712
H 0.853665 1.350920 -3.471186
H 1.370556 2.388509 -2.094190
H -5.588427 -0.571080 1.275036
H -5.786742 -0.193158 -0.469475
H -5.594480 -1.889529 0.065462
H 5.826628 0.775751 -0.628768


