%chk=000229142.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229142

0 1
O 3.260394 1.862202 0.169783
O 3.836437 -0.409981 -0.212554
O -1.443376 0.915737 0.492368
O -2.263904 0.643375 -1.611737
O -0.501316 -3.056793 -0.096887
O -2.042349 -1.561904 0.118774
N -0.866675 -1.900652 0.010262
C 2.120656 1.101514 0.149242
C 2.456966 -0.280175 -0.082364
C -0.168356 0.502627 0.234415
C 0.152137 -0.854376 0.026357
C 0.822605 1.518489 0.308590
C 1.511756 -1.263856 -0.148730
C 4.385700 0.935769 -0.067073
C -3.779541 0.777879 0.354780
C -2.523659 0.728371 -0.451062
C -4.906706 1.436208 -0.424958
H 0.537782 2.555613 0.479703
H 1.752978 -2.318091 -0.319779
H 5.020691 0.953252 0.829249
H 4.853294 1.222914 -1.019020
H -3.604999 1.290998 1.327933
H -4.038032 -0.278639 0.626715
H -5.066530 0.949418 -1.398672
H -5.852670 1.376020 0.128951
H -4.706882 2.497583 -0.620587


%chk=000229142-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229142

0 1
O 3.291634 1.852904 0.281505
O 3.869111 -0.392576 -0.352101
O -1.473929 0.853452 0.747322
O -2.240382 0.727441 -1.472482
O -0.388614 -3.182066 -0.306685
O -2.066629 -1.744631 0.231381
N -0.821790 -1.996780 -0.018762
C 2.145894 1.046962 0.238974
C 2.477900 -0.277791 -0.136396
C -0.174477 0.435096 0.404632
C 0.166391 -0.904424 0.041956
C 0.833396 1.427035 0.511029
C 1.516893 -1.270781 -0.239947
C 4.424371 0.968572 -0.137218
C -3.851544 0.998398 0.399409
C -2.509009 0.833968 -0.269245
C -4.971961 1.373342 -0.586559
H 0.560524 2.445686 0.791407
H 1.746942 -2.301504 -0.513581
H 5.164730 0.934591 0.678087
H 4.835415 1.349830 -1.087026
H -3.751233 1.736259 1.216178
H -4.062517 0.027742 0.890557
H -5.040892 0.634316 -1.402372
H -5.942638 1.406839 -0.062245
H -4.791184 2.361622 -1.044122


