%chk=000187111.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187111

1 1
O -2.078856 -1.038083 -1.259029
O -4.863253 -1.462888 0.420113
O -2.810146 1.824713 -0.084337
O 3.990633 1.120057 0.465315
O -0.904790 3.464089 0.602487
N -0.285882 -0.698133 0.208925
N 0.933852 1.159540 0.623124
N 1.678520 -2.234178 -0.295573
N 3.855577 -1.123048 -0.100713
N 3.744198 -3.434276 -0.543071
C -1.503592 -1.555476 -0.076321
C -2.531498 -1.470878 1.051078
C -3.705834 -0.634562 0.493239
C -3.335462 -0.333515 -0.980965
C 1.078174 -1.030589 0.050529
C -3.148721 1.145529 -1.314702
C -0.332004 0.664342 0.546132
C 1.832815 0.128375 0.323639
C 1.316615 2.547864 0.953377
C 3.326366 0.139238 0.255888
C 3.136924 -2.211836 -0.325561
C 0.460612 3.561209 0.179845
H -1.142022 -2.578880 -0.329649
H -2.136239 -1.057500 1.994866
H -2.908525 -2.487860 1.312784
H -3.909491 0.281611 1.088158
H -4.053219 -0.826071 -1.687341
H -4.088215 1.589760 -1.701548
H -2.334585 1.287638 -2.051667
H -1.285078 1.249568 0.666609
H -5.501852 -1.256520 1.138407
H 2.414509 2.689343 0.720152
H 1.222061 2.699304 2.058051
H 1.132844 -3.077222 -0.460276
H 0.416378 3.340633 -0.907129
H 0.843322 4.590644 0.324295
H -2.596010 2.778323 -0.270481
H 3.273698 -4.179613 -1.035737
H 4.766136 -3.440098 -0.614491
H -1.066759 4.008644 1.407079


%chk=000187111-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000187111

1 1
O -1.712158 -1.722541 -0.540818
O -4.645942 -2.098218 -0.000287
O -2.112962 1.317996 -0.276190
O 3.653655 1.457348 -0.054345
O -0.400203 3.433159 -0.049846
N -0.379376 -0.615130 1.075397
N 0.880621 1.206867 1.318140
N 1.186365 -1.886460 -0.418021
N 3.301527 -0.746679 -0.839918
N 2.899715 -2.867174 -1.728312
C -1.576365 -1.526357 0.894221
C -2.915531 -0.964535 1.424797
C -3.837119 -0.890757 0.164457
C -2.860297 -0.877055 -1.027613
C 0.806403 -0.813920 0.359297
C -2.409652 0.521646 -1.468094
C -0.313945 0.643220 1.625346
C 1.613826 0.307366 0.514801
C 1.261445 2.619371 1.572186
C 2.936471 0.416924 -0.131968
C 2.491884 -1.794227 -0.984676
C 1.035651 3.481112 0.319525
H -1.299389 -2.499200 1.333952
H -2.811755 0.041293 1.854226
H -3.342170 -1.640257 2.182620
H -4.460328 0.022334 0.192154
H -3.286699 -1.431964 -1.877899
H -3.236755 0.983123 -2.047362
H -1.528521 0.426257 -2.134539
H -1.092841 1.122688 2.203230
H -5.408480 -2.092957 0.631151
H 2.333461 2.644985 1.825826
H 0.662028 2.990383 2.419308
H 0.472258 -2.531851 -0.773250
H 1.654860 3.113972 -0.516779
H 1.337569 4.516991 0.559251
H -1.501970 2.101119 -0.436013
H 2.392549 -3.748754 -1.773883
H 3.816298 -2.795162 -2.169119
H -0.702924 4.314244 -0.375455


