%chk=000203358.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203358

0 1
O 1.079551 1.663588 0.787891
O 1.579872 2.226720 -1.345359
N -3.645775 2.178113 -0.424941
C -2.516488 2.787019 0.354460
C -1.235625 1.981237 0.087263
C -0.041052 2.603077 0.799735
C -4.770103 3.153770 -0.553764
C -4.127857 0.919944 0.217987
C 2.930023 0.586411 -0.163313
C 2.709132 -0.801157 -0.172060
C 1.823063 1.560935 -0.368250
C 4.227013 1.100718 -0.006651
C 3.810323 -1.666350 -0.030097
C 1.367608 -1.386200 -0.343497
C 5.307465 0.232351 0.144649
C 5.096206 -1.152553 0.131789
C 0.364920 -1.175758 0.517931
C -0.973688 -1.770755 0.371886
C -1.642348 -1.749491 -0.863109
C -1.597510 -2.352165 1.489228
C -2.917497 -2.309465 -0.978122
C -2.869281 -2.915610 1.365407
C -3.531677 -2.895111 0.133194
H -2.719644 2.840671 1.445112
H -2.370997 3.832579 0.002891
H -1.364663 0.926387 0.405302
H -1.045906 1.930627 -1.007844
H -0.193882 2.730697 1.886357
H 0.285053 3.550342 0.335978
H -4.415826 4.036752 -1.109746
H -5.206955 3.490099 0.397127
H -5.570426 2.697109 -1.158281
H -4.902072 0.466772 -0.420929
H -4.539837 1.042210 1.229422
H -3.294478 0.196518 0.268754
H 4.386862 2.180103 -0.008050
H 3.649811 -2.744078 -0.040233
H 1.259391 -2.032590 -1.218763
H 6.313406 0.629778 0.268766
H 5.941811 -1.830815 0.247425
H 0.497314 -0.526755 1.394641
H -1.171211 -1.285334 -1.729365
H -1.084804 -2.370624 2.449421
H -3.433092 -2.286731 -1.937509
H -3.346109 -3.372752 2.230995
H -4.522520 -3.334930 0.039874


%chk=000203358-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000203358

0 1
O 0.815078 1.373258 1.070803
O 1.781410 2.752773 -0.528744
N -3.683420 3.007074 -0.441280
C -2.593204 3.112857 0.555548
C -1.423294 2.145126 0.273116
C -0.268089 2.390263 1.254595
C -4.613159 4.152441 -0.360303
C -4.401115 1.716774 -0.391247
C 2.856028 0.628170 -0.037517
C 2.697105 -0.793577 -0.197667
C 1.776224 1.663936 0.098881
C 4.154283 1.206848 -0.124101
C 3.888009 -1.548212 -0.446025
C 1.453002 -1.597696 -0.234043
C 5.307777 0.426657 -0.319516
C 5.168406 -0.970608 -0.484413
C 0.274741 -1.441860 0.445770
C -0.899627 -2.328828 0.355798
C -1.032946 -3.379003 -0.600230
C -1.975070 -2.120047 1.268357
C -2.184351 -4.190071 -0.628102
C -3.128725 -2.931263 1.241786
C -3.239104 -3.973592 0.292733
H -2.971935 2.944680 1.601504
H -2.211366 4.152282 0.517229
H -1.753787 1.094165 0.363946
H -1.075472 2.302032 -0.762976
H -0.577216 2.248862 2.304243
H 0.168921 3.395308 1.116387
H -4.054354 5.096264 -0.491751
H -5.168458 4.210301 0.611601
H -5.358665 4.082028 -1.172503
H -5.179461 1.701621 -1.174567
H -4.899369 1.530281 0.595926
H -3.711703 0.879673 -0.591027
H 4.235632 2.295921 -0.048715
H 3.785624 -2.629292 -0.599122
H 1.557946 -2.494945 -0.863089
H 6.293316 0.901355 -0.363352
H 6.047640 -1.600771 -0.656912
H 0.188658 -0.603616 1.142293
H -0.238805 -3.554703 -1.334453
H -1.890366 -1.318063 2.012757
H -2.267201 -4.990564 -1.372144
H -3.938661 -2.752980 1.958050
H -4.133376 -4.605956 0.266079


