%chk=000201892.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201892

0 1
O 2.432716 0.132490 1.063557
O 1.164506 -1.080352 -2.043969
O 1.076313 1.896474 1.511929
N -1.513528 0.434554 -0.187090
N 0.855997 0.649349 -0.504312
C -2.155902 1.294456 0.856145
C -2.501113 -0.289896 -1.045763
C -3.069641 0.437197 1.746070
C -3.416694 -1.156475 -0.165068
C -4.113396 -0.313184 0.909848
C -0.478034 1.152054 -0.965925
C 2.586779 -0.897382 0.001502
C 1.461364 -0.537300 -1.013644
C 1.386176 0.999306 0.779471
C 2.334088 -2.233841 0.660156
C 3.963379 -0.705477 -0.591796
H -2.735268 2.133268 0.414378
H -1.341574 1.741609 1.475811
H -1.931717 -0.942581 -1.745861
H -3.114794 0.403595 -1.660377
H -3.562348 1.080775 2.497702
H -2.453585 -0.289169 2.313796
H -2.815182 -1.952216 0.318895
H -4.161605 -1.670142 -0.799658
H -4.728839 -0.960719 1.561505
H -4.813194 0.403270 0.439782
H -0.535483 0.945072 -2.063110
H -0.477504 2.258145 -0.807879
H 1.334443 -2.283655 1.117321
H 2.415328 -3.060848 -0.058549
H 3.055202 -2.417543 1.470485
H 4.745877 -0.871022 0.163886
H 4.145450 -1.401802 -1.422268
H 4.109983 0.316190 -0.970471


%chk=000201892-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201892

0 1
O 2.600599 0.101213 1.103042
O 1.052394 -1.164696 -1.920318
O 1.180640 1.890509 1.643618
N -1.613426 0.597371 -0.150528
N 0.842009 0.550448 -0.295033
C -2.376476 1.438190 0.800357
C -2.438765 -0.290095 -1.001642
C -3.278687 0.563912 1.696989
C -3.338913 -1.193540 -0.132875
C -4.189585 -0.345400 0.840000
C -0.438858 1.180935 -0.758580
C 2.656103 -0.931794 -0.005643
C 1.436592 -0.569056 -0.884335
C 1.498601 0.951996 0.897025
C 2.496253 -2.321984 0.626606
C 3.977517 -0.751184 -0.766565
H -3.019277 2.177334 0.257024
H -1.657834 2.004675 1.419073
H -1.763747 -0.904789 -1.623739
H -3.088274 0.305775 -1.693335
H -3.884331 1.217851 2.353402
H -2.635955 -0.061444 2.346466
H -2.696227 -1.885368 0.445787
H -3.987155 -1.805161 -0.789400
H -4.802455 -0.999211 1.488669
H -4.894584 0.284651 0.257631
H -0.435832 1.054912 -1.857450
H -0.345119 2.253481 -0.510895
H 1.563109 -2.387532 1.211401
H 2.467521 -3.086064 -0.169415
H 3.347358 -2.529083 1.296805
H 4.827815 -0.969004 -0.098826
H 4.005201 -1.444118 -1.625367
H 4.081989 0.280468 -1.143453


