%chk=000248940.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248940

0 1
O 2.228533 -0.063955 0.000190
O -5.606682 -2.935910 0.000292
O 0.447960 -1.503926 0.000171
N -5.384949 1.336440 -0.000198
N 0.186186 0.844631 0.000294
C -3.461827 0.070696 0.000040
C -3.969597 1.415236 -0.000098
C -4.606506 -0.806519 0.000005
C -2.076198 -0.146887 0.000164
C -1.240179 0.967208 0.000148
C -3.117579 2.531662 -0.000113
C -5.752049 -0.004666 -0.000109
C -1.754001 2.301655 0.000009
C -4.589736 -2.266797 0.000105
C 4.499948 -0.609759 0.000104
C 3.133227 -1.227805 0.000218
C 0.878030 -0.370994 0.000212
C 5.139651 -0.320364 -1.214373
C 5.139668 -0.319952 1.214471
C 6.418625 0.242931 -1.211395
C 6.418643 0.243343 1.211284
C 7.059528 0.523158 -0.000107
H -1.676116 -1.165588 0.000263
H -6.003198 2.125508 -0.000319
H -3.518004 3.542544 -0.000212
H -6.784165 -0.331667 -0.000152
H -1.065593 3.144628 0.000002
H 0.741484 1.705821 0.000318
H -3.592235 -2.736344 -0.000055
H 2.911134 -1.827711 -0.901069
H 2.911233 -1.827582 0.901615
H 4.639120 -0.529280 -2.159079
H 4.639152 -0.528547 2.159256
H 6.915575 0.465317 -2.154510
H 6.915604 0.466050 2.154318
H 8.056613 0.960826 -0.000190


%chk=000248940-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248940

0 1
O 2.237314 0.012021 0.000113
O -5.791893 -2.983148 -0.000345
O 0.455732 -1.536171 0.000269
N -5.456644 1.337426 -0.000055
N 0.127473 0.815540 0.000078
C -3.552563 0.064408 0.000135
C -4.049526 1.411011 -0.000046
C -4.717149 -0.817017 0.000268
C -2.156619 -0.174999 0.000181
C -1.290453 0.942765 0.000041
C -3.189625 2.527597 -0.000181
C -5.855047 0.011007 0.000106
C -1.806953 2.278960 -0.000139
C -4.738628 -2.276884 0.000509
C 4.589291 -0.581497 0.000105
C 3.190792 -1.147315 0.000181
C 0.873799 -0.350564 0.000184
C 5.255062 -0.309604 -1.221635
C 5.255041 -0.309232 1.221775
C 6.560484 0.229841 -1.223898
C 6.560460 0.230215 1.223897
C 7.215896 0.501028 -0.000036
H -1.739404 -1.183663 0.000317
H -6.084527 2.139516 -0.000172
H -3.568819 3.554706 -0.000319
H -6.901690 -0.286251 0.000133
H -1.108282 3.124493 -0.000247
H 0.678911 1.676184 0.000000
H -3.733163 -2.765705 -0.000243
H 2.981899 -1.758869 -0.895477
H 2.981938 -1.758725 0.895948
H 4.747656 -0.519942 -2.170942
H 4.747617 -0.519282 2.171136
H 7.066401 0.434510 -2.173878
H 7.066361 0.435174 2.173824
H 8.230159 0.915867 -0.000090


