%chk=000266723.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266723

0 1
O 1.283273 1.799005 1.079511
O -1.993711 2.412394 1.838928
O -1.815208 -2.137943 -2.228703
O -3.706643 2.656375 -0.220960
O 3.848533 2.545153 -0.253092
N 0.389487 -3.210822 1.217802
C 0.366243 -0.377047 0.897934
C -0.826196 -1.247267 0.444667
C -0.035145 1.116898 0.802278
C -0.129358 -2.558587 -0.030820
C -1.502672 1.172480 1.321631
C -1.773104 -1.340210 1.697594
C 0.960950 -0.948017 2.207942
C 1.533490 -0.252216 -0.024597
C -1.740585 -0.492239 -0.514456
C -1.894817 0.071216 2.340687
C -2.204245 0.757935 0.006453
C 0.956916 -2.339167 -1.152206
C 1.417127 -2.401387 1.960425
C 1.904025 -1.184108 -0.968360
C 2.112172 1.015902 0.213050
C -2.264871 -0.925465 -1.728841
C -3.179551 1.479835 -0.672261
C 0.908021 -4.584670 0.954126
C 3.072762 -0.854031 -1.683107
C 3.273985 1.319047 -0.505304
C -3.230150 -0.169454 -2.436920
C 3.743102 0.350459 -1.429252
C -3.695488 1.021594 -1.911519
C -1.088116 3.538914 1.746586
C 5.087314 2.852502 -0.935769
H -0.139232 1.462277 -0.277001
H -0.905840 -3.242066 -0.464941
H -1.392317 -2.074346 2.430806
H -2.763553 -1.720311 1.394427
H 0.248413 -0.896617 3.050051
H 1.824941 -0.332993 2.530954
H -2.930843 0.253866 2.679895
H -1.258392 0.149874 3.241234
H 0.402558 -2.174687 -2.106282
H 1.518852 -3.281978 -1.284423
H 2.399220 -2.391442 1.437529
H 1.574137 -2.903998 2.939744
H 1.817700 -4.626257 0.335829
H 0.123894 -5.180068 0.459633
H 1.123092 -5.073734 1.918321
H 3.458671 -1.528454 -2.443102
H -3.609086 -0.534612 -3.389144
H 4.649062 0.562110 -1.992956
H -4.449075 1.620894 -2.420187
H -0.947162 3.823914 0.699675
H -0.125948 3.294882 2.216659
H -1.614573 4.315508 2.312332
H -2.292377 -2.379738 -3.057811
H -3.353633 2.880047 0.708961
H 5.865376 2.135199 -0.660855
H 5.314330 3.850099 -0.536213
H 4.928047 2.891951 -2.016880


%chk=000266723-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000266723

0 1
O 1.331307 1.861646 0.965096
O -1.998600 2.598673 1.519390
O -1.952852 -2.296712 -2.260305
O -3.635071 2.789657 -0.447572
O 3.938255 2.569828 -0.380396
N 0.456504 -3.125032 1.257828
C 0.358713 -0.309555 0.784280
C -0.821963 -1.218798 0.373000
C -0.039112 1.160302 0.672008
C -0.102674 -2.564456 -0.012583
C -1.533370 1.252238 1.170839
C -1.766716 -1.279846 1.646344
C 0.968941 -0.818900 2.138828
C 1.531361 -0.225024 -0.136227
C -1.755941 -0.494961 -0.621533
C -1.939647 0.174096 2.233430
C -2.215402 0.781575 -0.143870
C 0.979452 -2.401884 -1.173632
C 1.467029 -2.274345 1.939279
C 1.930584 -1.206295 -1.035243
C 2.138496 1.026315 0.085131
C -2.334085 -1.006158 -1.803196
C -3.178077 1.538214 -0.858747
C 0.880028 -4.530254 1.163357
C 3.116575 -0.897439 -1.754128
C 3.328075 1.328875 -0.610201
C -3.300495 -0.252678 -2.517799
C 3.800002 0.328170 -1.521178
C -3.718129 1.005373 -2.056083
C -1.231376 3.259136 2.587608
C 5.159797 2.865443 -1.131607
H -0.126087 1.424902 -0.396086
H -0.842063 -3.295262 -0.382970
H -1.344886 -1.971568 2.391376
H -2.747684 -1.683822 1.339840
H 0.255118 -0.785649 2.974164
H 1.825068 -0.179711 2.416514
H -3.000046 0.361959 2.479855
H -1.359410 0.301401 3.164531
H 0.417992 -2.314007 -2.123202
H 1.546404 -3.352136 -1.238662
H 2.436655 -2.263390 1.385258
H 1.673683 -2.725319 2.929943
H 1.816484 -4.689152 0.571339
H 0.077837 -5.131185 0.698105
H 1.061914 -4.929625 2.178958
H 3.520457 -1.590388 -2.502064
H -3.732243 -0.657351 -3.443382
H 4.713186 0.524560 -2.092885
H -4.458739 1.596407 -2.601981
H -0.156791 3.279936 2.331635
H -1.384423 2.744502 3.554501
H -1.626854 4.284428 2.648642
H -2.454702 -2.518909 -3.083030
H -3.124021 3.037297 0.389690
H 5.963228 2.139574 -0.897672
H 5.460056 3.870752 -0.801574
H 4.972057 2.870952 -2.223263


