%chk=000299093.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299093

0 1
O 0.687912 -0.808653 0.681847
O 0.076683 -2.654751 -0.483194
O -6.205278 0.416060 -1.015686
O -5.500228 2.034897 0.235336
N 3.613210 2.061902 -0.219824
N -5.349251 0.978503 -0.354775
C 2.999739 -0.358814 0.014120
C 2.793733 1.086026 0.568854
C 2.637835 -0.385805 -1.491487
C 4.459746 -0.833275 0.210749
C 2.066199 -1.299227 0.814020
C 2.703600 -1.763321 -2.142371
C 4.909747 -0.966082 1.662416
C 4.689328 2.671780 0.615709
C 2.757053 3.128017 -0.819655
C -0.205628 -1.573769 -0.018216
C -1.530195 -0.885689 -0.085954
C -2.546732 -1.494304 -0.838125
C -1.756781 0.327271 0.579612
C -3.800099 -0.886927 -0.929180
C -3.007592 0.941019 0.494469
C -4.016017 0.326235 -0.260831
H 1.708290 1.322843 0.521631
H 3.052096 1.097564 1.648377
H 3.322094 0.309017 -2.025335
H 1.623303 0.036964 -1.623942
H 5.121600 -0.114534 -0.319575
H 4.603548 -1.801949 -0.310187
H 2.225164 -1.246991 1.903999
H 2.130242 -2.346423 0.468212
H 3.679663 -2.240232 -1.995831
H 2.535280 -1.692300 -3.222893
H 1.938709 -2.445315 -1.742217
H 4.683345 -0.065880 2.245685
H 5.994121 -1.123470 1.717727
H 4.438750 -1.817462 2.165252
H 5.339230 1.870666 1.004415
H 4.335035 3.276368 1.462855
H 5.316826 3.312429 -0.025014
H 3.385545 3.773592 -1.454626
H 2.232356 3.767054 -0.095106
H 2.009611 2.659034 -1.479580
H -2.349788 -2.444185 -1.348329
H -0.951488 0.785766 1.162771
H -4.608163 -1.344890 -1.511390
H -3.207456 1.888843 1.006967


%chk=000299093-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000299093

0 1
O 0.618196 -0.696567 0.603542
O -0.067899 -2.746588 -0.292872
O -6.521169 0.033609 -0.900152
O -5.763073 1.974334 0.028391
N 3.828637 2.136302 -0.089914
N -5.589513 0.764712 -0.387446
C 3.013412 -0.291641 0.002056
C 2.914472 1.170369 0.567165
C 2.665229 -0.251373 -1.519730
C 4.455078 -0.860459 0.201168
C 2.023293 -1.186479 0.782564
C 2.693643 -1.592184 -2.289272
C 4.921600 -1.099974 1.657719
C 4.897908 2.662329 0.778984
C 3.148283 3.199916 -0.852980
C -0.319065 -1.568278 0.061761
C -1.670680 -0.928235 -0.041680
C -2.726448 -1.694545 -0.600223
C -1.909385 0.398453 0.401985
C -4.016202 -1.145893 -0.718232
C -3.195345 0.959433 0.291678
C -4.228459 0.175969 -0.268213
H 1.863501 1.505089 0.449642
H 3.108362 1.148351 1.661288
H 3.379218 0.454660 -1.985767
H 1.657534 0.199375 -1.630332
H 5.138234 -0.144230 -0.295681
H 4.544617 -1.815527 -0.350507
H 2.198373 -1.122513 1.870449
H 2.069732 -2.240582 0.457599
H 3.704523 -2.037073 -2.314215
H 2.388311 -1.425866 -3.339115
H 1.999452 -2.337750 -1.860859
H 4.816704 -0.197148 2.287240
H 5.989129 -1.386813 1.669684
H 4.361975 -1.917784 2.147858
H 5.452930 1.830676 1.245948
H 4.521804 3.328106 1.597342
H 5.615372 3.246183 0.173396
H 3.892354 3.772802 -1.436610
H 2.589640 3.924427 -0.207297
H 2.432202 2.755635 -1.565179
H -2.513566 -2.715035 -0.932937
H -1.085781 0.973118 0.832132
H -4.849158 -1.710800 -1.143950
H -3.413080 1.977092 0.625273


