%chk=000294936.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294936

0 1
O -0.498973 0.369327 0.000255
O 3.107970 -2.251187 -0.001661
O 5.135673 -1.314464 0.002416
O 0.972385 2.127623 -0.000107
N 1.693370 -0.105336 0.000534
C 3.155148 0.178113 -0.000031
C 3.552005 0.935858 1.268867
C 3.551458 0.934255 -1.270076
C 3.941178 -1.157527 0.000550
C 0.768537 0.928504 0.000280
C -1.605336 1.341069 -0.000022
C -2.833167 0.478671 0.000042
C -3.407436 0.074219 -1.214205
C -3.407899 0.075054 1.214346
C -4.559042 -0.717567 -1.211135
C -4.559506 -0.716733 1.211379
C -5.136930 -1.111600 0.000148
H 4.635792 1.105193 1.318992
H 3.065902 1.927233 1.293211
H 3.249757 0.411191 2.183047
H 4.635162 1.103896 -1.320726
H 3.065089 1.925475 -1.295578
H 3.249056 0.408302 -2.183466
H 1.370024 -1.078456 0.000296
H -1.501064 1.972543 -0.900933
H -1.501206 1.972892 0.900661
H -2.953458 0.371058 -2.158737
H -2.954286 0.372539 2.158850
H 3.601545 -3.115555 -0.001373
H -5.005017 -1.029873 -2.154106
H -5.005842 -1.028388 2.154395
H -6.034589 -1.727729 0.000187


%chk=000294936-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000294936

0 1
O -0.468745 0.282173 -0.001400
O 3.151493 -2.270239 -0.000366
O 5.232665 -1.246853 0.002004
O 0.990780 2.137476 -0.001056
N 1.766296 -0.093923 -0.001270
C 3.219484 0.187264 -0.000236
C 3.640219 0.972881 1.277845
C 3.642293 0.971614 -1.278465
C 3.990239 -1.142924 0.000959
C 0.807569 0.889254 -0.002103
C -1.613803 1.250038 -0.000554
C -2.888249 0.441812 -0.000062
C -3.497009 0.056920 -1.221100
C -3.496003 0.056807 1.221440
C -4.688712 -0.701592 -1.223019
C -4.687710 -0.701697 1.224272
C -5.286865 -1.082632 0.000856
H 4.731210 1.130690 1.279699
H 3.125521 1.947064 1.278291
H 3.355990 0.418378 2.189268
H 4.733257 1.129636 -1.278595
H 3.127421 1.945703 -1.280802
H 3.359730 0.416097 -2.189789
H 1.459237 -1.069218 -0.001439
H -1.522327 1.890861 -0.895617
H -1.521399 1.890455 0.894704
H -3.033840 0.351453 -2.170601
H -3.032048 0.351247 2.170587
H 3.703071 -3.097934 0.000033
H -5.151054 -0.991908 -2.172969
H -5.149271 -0.992094 2.174576
H -6.213143 -1.668210 0.001210


