%chk=000221263.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221263

0 1
O -0.411539 -0.524275 0.281503
O 0.761468 1.416604 -0.132540
N 1.801176 -0.672813 0.180924
C -1.746306 0.122375 0.470566
C -2.624692 -1.111188 0.759304
C -2.093595 0.913264 -0.796099
C -2.845440 -2.058200 -0.440330
C -3.336514 1.819946 -0.668828
C -1.656007 -3.004581 -0.632022
C -4.140712 -2.857573 -0.244376
C -4.642179 1.017408 -0.645186
C -3.353535 2.824354 -1.829873
C -1.647440 0.964661 1.657094
C 0.727890 0.227281 0.090849
C -1.556547 1.656991 2.638380
C 3.175674 -0.333887 -0.024639
C 4.117599 -1.379012 0.076936
C 3.589311 0.977967 -0.313071
C 5.470332 -1.094428 -0.113007
C 4.947757 1.236031 -0.499142
C 5.891245 0.207841 -0.401082
H -2.184245 -1.677901 1.604149
H -3.609101 -0.733153 1.119046
H -2.218126 0.208601 -1.644032
H -1.218405 1.551202 -1.065369
H -2.952236 -1.435781 -1.368331
H -3.258913 2.396892 0.288010
H -0.720815 -2.435464 -0.728992
H -1.771020 -3.614246 -1.533432
H -1.536036 -3.686818 0.215382
H -5.018442 -2.204722 -0.202009
H -4.297741 -3.560247 -1.070608
H -4.118875 -3.446608 0.678867
H -4.671633 0.325401 0.207385
H -5.511082 1.679008 -0.561523
H -4.771523 0.423451 -1.556109
H -4.217256 3.494310 -1.761764
H -2.454329 3.451509 -1.830257
H -3.404810 2.323098 -2.802121
H -1.474049 2.255731 3.477618
H 1.579863 -1.649565 0.396679
H 3.804190 -2.394925 0.300252
H 2.857530 1.788722 -0.389564
H 6.203263 -1.897299 -0.035534
H 5.272907 2.252453 -0.722970
H 6.947139 0.420185 -0.547833


%chk=000221263-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221263

0 1
O -0.363272 -0.550870 0.239807
O 0.811308 1.511496 0.070774
N 1.876440 -0.605080 0.099928
C -1.730789 0.093349 0.454935
C -2.638964 -1.129442 0.799572
C -2.098525 0.887782 -0.835137
C -3.034724 -2.112259 -0.335906
C -3.362801 1.795343 -0.774338
C -1.853976 -2.959828 -0.866330
C -4.164403 -3.037629 0.182984
C -4.705704 1.037548 -0.915943
C -3.254708 2.873636 -1.882465
C -1.657921 0.965477 1.648558
C 0.789917 0.258847 0.132007
C -1.654537 1.634267 2.682766
C 3.252018 -0.276280 -0.046021
C 4.177722 -1.354101 -0.085656
C 3.722155 1.060214 -0.147449
C 5.556993 -1.100814 -0.225771
C 5.106918 1.295189 -0.288799
C 6.032579 0.227399 -0.329249
H -2.126118 -1.690184 1.605487
H -3.561639 -0.717003 1.249416
H -2.185077 0.170629 -1.673881
H -1.234538 1.540840 -1.047093
H -3.446515 -1.527841 -1.182159
H -3.356571 2.317097 0.204286
H -1.059071 -2.329637 -1.297520
H -2.205235 -3.664515 -1.643716
H -1.404336 -3.554029 -0.047318
H -5.055627 -2.458744 0.491054
H -4.477017 -3.753319 -0.599488
H -3.822025 -3.623711 1.057872
H -4.869978 0.302195 -0.109458
H -5.550108 1.751502 -0.889790
H -4.753309 0.500942 -1.883647
H -4.134869 3.543053 -1.871156
H -2.349841 3.493978 -1.748731
H -3.200527 2.404915 -2.884468
H -1.618842 2.246515 3.565011
H 1.637183 -1.595137 0.188334
H 3.816679 -2.387819 -0.007572
H 3.009870 1.886844 -0.112296
H 6.258829 -1.941698 -0.254607
H 5.463005 2.328749 -0.366136
H 7.104152 0.424734 -0.438390


