%chk=000183821.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183821

0 1
O -4.720476 0.027929 0.549508
N -2.085691 2.222563 -0.661434
N -2.374504 -3.087859 1.425853
N -0.290865 -4.197742 1.548038
C -1.282976 3.405926 -0.198338
C -0.014697 2.924282 0.543930
C 0.860063 1.977309 -0.283832
C -2.895968 1.604960 0.426646
C 2.120510 1.561711 0.489810
C -0.936381 4.276480 -1.413476
C -3.429083 0.238147 -0.070781
C 2.885079 0.487215 -0.233898
C -2.569812 -0.922700 0.347552
C 2.977793 -0.803094 0.310269
C 3.521010 0.767988 -1.454254
C -1.212108 -0.960491 -0.006647
C -3.105977 -2.004886 1.071584
C 3.695659 -1.798149 -0.359015
C 4.234583 -0.230761 -2.120487
C -0.432771 -2.057456 0.341601
C 4.324165 -1.516127 -1.575466
C -1.043068 -3.107220 1.072082
H -1.872422 4.035183 0.524222
H 0.572631 3.809601 0.854228
H -0.317567 2.416571 1.481813
H 1.139260 2.449910 -1.243645
H 0.264384 1.073590 -0.560830
H -2.700123 2.497793 -1.435315
H -2.254918 1.450635 1.324112
H -3.746536 2.231937 0.769115
H 2.775925 2.442459 0.649968
H 1.839257 1.220300 1.507337
H -0.449565 3.688493 -2.203205
H -1.823194 4.746534 -1.849822
H -0.242704 5.078640 -1.137271
H -3.570923 0.229084 -1.177189
H 2.492744 -1.030450 1.258459
H 3.457589 1.766403 -1.881371
H -0.760432 -0.111568 -0.548276
H -5.407375 0.542342 0.091044
H -4.164274 -2.010266 1.374855
H 3.768437 -2.795025 0.071732
H 4.724236 -0.007362 -3.066790
H 0.619346 -2.098651 0.074708
H 4.882222 -2.291142 -2.095027
H 0.497084 -4.485871 0.989246
H -0.820066 -4.973365 1.930856


%chk=000183821-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183821

0 1
O -4.715120 0.151426 1.468442
N -2.270555 2.142901 -0.605244
N -1.463949 -2.375005 1.796135
N 0.178659 -3.745452 0.851692
C -1.328830 3.285239 -0.438039
C -0.077549 2.869358 0.384155
C 0.823864 1.808212 -0.283315
C -3.078593 1.774942 0.566454
C 1.949931 1.320720 0.670962
C -0.958176 3.827856 -1.833836
C -3.733818 0.372929 0.389385
C 2.895976 0.331392 0.005534
C -2.727444 -0.758290 0.449296
C 2.718100 -1.068218 0.157879
C 3.960053 0.789034 -0.815837
C -2.022913 -1.181910 -0.706649
C -2.406961 -1.397695 1.670046
C 3.579473 -1.982971 -0.490564
C 4.821159 -0.121470 -1.468609
C -1.045471 -2.186643 -0.611399
C 4.633991 -1.514495 -1.308091
C -0.785422 -2.761625 0.668809
H -1.823459 4.116988 0.127249
H 0.511530 3.786636 0.594397
H -0.406457 2.486006 1.371938
H 1.290528 2.219638 -1.199982
H 0.202769 0.947937 -0.594444
H -2.850650 2.256797 -1.447616
H -2.433212 1.741537 1.461748
H -3.894357 2.518537 0.781704
H 2.518075 2.203728 1.028538
H 1.482248 0.857088 1.561447
H -0.548895 3.023216 -2.470160
H -1.844334 4.253844 -2.342530
H -0.199220 4.626031 -1.753437
H -4.250375 0.357917 -0.598627
H 1.904322 -1.445216 0.789041
H 4.118100 1.868557 -0.937517
H -2.231455 -0.717922 -1.676700
H -5.287306 0.957081 1.547869
H -2.945050 -1.128318 2.583891
H 3.435420 -3.061101 -0.348496
H 5.640062 0.252332 -2.094414
H -0.487331 -2.516112 -1.494014
H 5.304816 -2.223028 -1.807464
H 0.698190 -4.133320 0.070323
H 0.277135 -4.145286 1.782248


