%chk=000208119.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208119

0 1
O 3.660603 -1.894350 0.114407
O 2.579176 2.498596 -0.750789
O -1.858432 1.451613 0.504096
N 1.454027 -1.276065 0.311369
N 3.153514 0.327202 -0.330948
N -0.874317 -0.669225 0.479514
N -3.211486 -0.402189 0.840735
C 0.463262 -0.267073 0.224302
C 2.847066 -0.992374 0.028511
C -4.448316 0.422296 0.731939
C 0.823967 1.002052 -0.122885
C -5.011150 0.487312 -0.694591
C 2.173405 1.403873 -0.428027
C 1.136749 -2.673025 0.699526
C -1.985752 0.248614 0.572069
C 4.584405 0.616861 -0.619862
C -5.599836 -0.836438 -1.168869
H -4.223902 1.454219 1.098843
H -5.190413 -0.018101 1.435816
H 0.081225 1.814767 -0.177009
H -5.791281 1.276634 -0.730819
H -4.223462 0.830007 -1.397285
H -1.035562 -1.647246 0.731686
H 0.700297 -2.718144 1.710425
H 2.076001 -3.274011 0.727318
H 0.473938 -3.153153 -0.037873
H -3.335999 -1.371947 0.552541
H 5.210991 0.398609 0.261266
H 4.697154 1.687396 -0.881964
H 4.941934 0.004209 -1.464392
H -6.372543 -1.207726 -0.485165
H -6.070843 -0.723766 -2.154540
H -4.838817 -1.616827 -1.268441


%chk=000208119-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208119

0 1
O 3.629673 -1.983240 0.100967
O 2.781132 2.562181 -0.676857
O -1.903868 1.604498 0.264817
N 1.417722 -1.212310 0.270670
N 3.208707 0.282469 -0.285747
N -0.832341 -0.505588 0.464122
N -3.157020 -0.319944 0.686375
C 0.500023 -0.143353 0.199474
C 2.813926 -1.016878 0.029222
C -4.441821 0.405144 0.720090
C 0.922979 1.135070 -0.112621
C -5.182862 0.422144 -0.638155
C 2.315781 1.421467 -0.381191
C 1.003389 -2.591407 0.592424
C -1.966000 0.358395 0.451524
C 4.651466 0.492594 -0.536914
C -5.586928 -0.980198 -1.141781
H -4.215507 1.438568 1.032841
H -5.079519 -0.059793 1.496539
H 0.208121 1.953333 -0.154862
H -6.088096 1.049568 -0.519091
H -4.541845 0.927673 -1.384468
H -0.996985 -1.476968 0.729615
H 0.567121 -2.660400 1.607451
H 1.917146 -3.204862 0.571154
H 0.298821 -2.989928 -0.161908
H -3.183077 -1.340007 0.713919
H 5.237982 0.201663 0.350018
H 4.784031 1.562245 -0.755948
H 4.983078 -0.121664 -1.390325
H -6.233246 -1.499995 -0.408418
H -6.146548 -0.913426 -2.091658
H -4.699832 -1.614451 -1.330375


