%chk=000298303.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298303

0 1
O 1.402105 0.270751 1.338529
O 0.223793 1.902308 -0.960076
O -1.420123 -0.905099 -1.304855
O -1.817488 -0.514137 1.878622
O 1.156475 -2.002592 1.752613
O 4.975130 1.456678 0.568897
O 4.342013 -0.594445 0.298618
O 1.411522 2.073184 -2.871539
O -3.434585 0.115021 -1.147131
O -3.097936 -2.283756 1.271704
N 4.169114 0.608652 0.241630
C 0.451110 0.459609 -0.900331
C -0.859178 -0.044980 -0.268319
C 1.707295 0.133676 -0.068717
C -0.748708 -0.930513 0.983702
C 0.521293 -0.730870 1.840097
C 2.852920 1.115554 -0.300886
C 0.691770 2.603661 -2.057932
C -2.766639 -0.766776 -1.627400
C -2.984038 -1.273249 1.918296
C 2.382086 -2.138978 2.507375
C -3.127762 -1.835599 -2.589961
C 0.187978 3.996686 -1.985055
C -3.935662 -0.606700 2.841559
H 0.563061 0.070817 -1.946358
H -1.553232 0.819635 -0.069924
H 2.024118 -0.929001 -0.254158
H -0.879297 -2.015420 0.711450
H 0.334046 -0.399272 2.882633
H 2.976642 1.329679 -1.395174
H 2.615221 2.095451 0.187290
H 2.665689 -3.179423 2.304839
H 2.195672 -1.977973 3.571326
H 3.138734 -1.446572 2.116944
H -3.635141 -2.665364 -2.062737
H -3.820546 -1.463140 -3.360382
H -2.248510 -2.271464 -3.092580
H -0.552241 4.185839 -2.782008
H 1.004475 4.723854 -2.125629
H -0.306707 4.219907 -1.023629
H -4.756318 -0.135840 2.270691
H -4.392538 -1.333211 3.532188
H -3.462011 0.188513 3.440781


%chk=000298303-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298303

0 1
O 1.421205 0.409175 1.457242
O 0.354894 1.880186 -1.258537
O -1.678989 -0.409798 -1.178599
O -1.795740 -1.015064 1.820737
O 1.336175 -1.951994 1.991871
O 4.945725 1.835987 0.841892
O 4.442131 -0.382187 0.707968
O 1.530495 1.507090 -3.241611
O -3.495756 0.749163 -0.262410
O -2.731907 -2.808336 0.639635
N 4.186697 0.860482 0.497764
C 0.542446 0.450428 -0.860763
C -0.759428 0.085824 -0.121745
C 1.785695 0.236033 0.035928
C -0.589170 -1.006713 0.955978
C 0.593012 -0.719717 1.915733
C 2.906571 1.222896 -0.256615
C 0.835253 2.262541 -2.526394
C -3.036933 -0.033773 -1.120742
C -2.812445 -1.954861 1.547266
C 2.406101 -1.949697 3.010754
C -3.803492 -0.744550 -2.208836
C 0.384485 3.664406 -2.855976
C -3.973470 -1.726335 2.483716
H 0.646359 -0.146593 -1.784656
H -1.191629 0.990463 0.343223
H 2.149327 -0.801456 -0.106911
H -0.469469 -2.000504 0.487607
H 0.230924 -0.386512 2.906316
H 3.169127 1.214456 -1.329463
H 2.650687 2.244908 0.058204
H 2.790328 -2.980096 3.031436
H 1.995986 -1.678188 4.003944
H 3.213102 -1.252014 2.729253
H -3.933715 -1.801730 -1.912507
H -4.791004 -0.278810 -2.339297
H -3.242533 -0.734234 -3.157225
H -0.700503 3.664398 -3.064358
H 0.922742 4.031065 -3.741535
H 0.550636 4.338222 -1.999143
H -4.510539 -0.813953 2.165538
H -4.659534 -2.584748 2.446044
H -3.620240 -1.560756 3.514276


