%chk=000213863.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213863

0 1
O -2.737829 -2.988832 0.538353
N -2.252411 -0.778776 0.444311
N 0.472398 -1.893905 -0.477564
C -1.573383 0.375302 -0.033109
C -3.588475 -0.371776 1.014238
C -3.775184 1.109682 0.599368
C -2.448714 1.508182 0.014121
C -0.245846 0.496381 -0.440307
C -1.999066 -2.126667 0.106634
C -2.014622 2.738860 -0.427300
C 0.712302 -0.629572 -0.340954
C 0.172485 1.771284 -0.898167
C -0.838670 -2.427224 -0.837025
C -0.689532 2.857624 -0.906262
C 2.122876 -0.259531 -0.009903
C 2.387608 0.512502 1.131819
C 3.175581 -0.691100 -0.829096
C 3.704448 0.857384 1.444374
C 4.490460 -0.337102 -0.511937
C 4.755708 0.436623 0.621988
H -3.556233 -0.495285 2.116749
H -4.389105 -1.033982 0.626586
H -4.042295 1.738978 1.467883
H -4.591089 1.226739 -0.137988
H -2.667874 3.609036 -0.409731
H 1.201681 1.889361 -1.245593
H -0.711435 -3.545641 -0.857317
H -1.135717 -2.132212 -1.872991
H -0.345345 3.823509 -1.272695
H 1.568048 0.836198 1.772929
H 2.967238 -1.311691 -1.700826
H 3.912746 1.452391 2.332086
H 5.309041 -0.671773 -1.147188
H 5.780808 0.708034 0.868416


%chk=000213863-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213863

0 1
O -2.653481 -3.099438 0.330264
N -2.218038 -0.814006 0.412218
N 0.467823 -1.808641 -0.653116
C -1.608501 0.382307 -0.049509
C -3.465945 -0.480091 1.168575
C -3.835681 0.949140 0.665941
C -2.525215 1.462882 0.077848
C -0.268111 0.570817 -0.484176
C -1.974565 -2.110627 -0.061500
C -2.150273 2.750584 -0.324447
C 0.735297 -0.535756 -0.420620
C 0.080458 1.892733 -0.899242
C -0.875852 -2.193280 -1.137314
C -0.840605 2.955916 -0.841533
C 2.150552 -0.216335 -0.036056
C 2.472114 0.860889 0.833753
C 3.200544 -1.047116 -0.513426
C 3.811709 1.104738 1.209130
C 4.537663 -0.798646 -0.144008
C 4.849883 0.280530 0.718011
H -3.248271 -0.484408 2.252086
H -4.226692 -1.249442 0.965509
H -4.211359 1.585319 1.484950
H -4.623268 0.907485 -0.110854
H -2.851467 3.588576 -0.243243
H 1.096031 2.074273 -1.264960
H -0.839431 -3.242001 -1.467071
H -1.199290 -1.553548 -1.990262
H -0.538382 3.953153 -1.177554
H 1.674477 1.493396 1.237265
H 2.938459 -1.887667 -1.163172
H 4.043318 1.931761 1.889632
H 5.337168 -1.443666 -0.525295
H 5.889534 0.473172 1.006081


