%chk=000211316.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211316

0 1
O 0.351894 1.503183 -0.775222
O 0.938521 -0.753682 1.398809
O 2.044146 2.855555 -0.711167
N -2.703870 -0.396804 -0.308415
C -1.746348 0.537830 -0.964730
C -3.114693 -1.534881 -1.201274
C -3.884368 0.310690 0.322977
C -0.319694 0.254696 -0.442904
C -0.221406 0.049750 1.064372
C -1.890755 -2.396500 -1.539019
C -3.843472 -1.098060 -2.483129
C -3.410911 1.454645 1.232565
C -4.689824 -0.694269 1.161781
C 1.676098 1.733320 -0.441525
C 2.177829 -0.406712 0.941529
C 2.533238 0.672327 0.120590
C 3.148648 -1.329656 1.417291
C 3.911854 0.818346 -0.197701
C 4.475522 -1.160706 1.070921
C 4.863971 -0.077265 0.255468
H -1.743741 0.455248 -2.074283
H -1.985151 1.610195 -0.755993
H -3.820711 -2.168880 -0.594515
H -4.552760 0.739731 -0.470788
H 0.180352 -0.567711 -0.998211
H -0.169181 0.999990 1.622014
H -1.039979 -0.592885 1.461879
H -2.199274 -3.357235 -1.965281
H -1.227004 -1.918593 -2.266370
H -1.300142 -2.609915 -0.638339
H -4.759282 -0.541565 -2.259313
H -4.127973 -1.965773 -3.087878
H -3.216943 -0.458895 -3.115630
H -4.265077 1.971233 1.683758
H -2.780786 1.086548 2.050049
H -2.828036 2.207037 0.683031
H -5.135186 -1.483775 0.544635
H -5.504122 -0.193987 1.696195
H -4.055446 -1.186476 1.909905
H 2.817310 -2.151121 2.050985
H 4.208946 1.672791 -0.817734
H 5.230033 -1.863209 1.429108
H 5.911674 0.051340 -0.007340


%chk=000211316-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211316

0 1
O 0.435204 1.464123 -0.970345
O 1.012167 -0.476281 1.582258
O 2.331314 2.627427 -1.355729
N -2.746909 -0.391156 -0.273084
C -1.763231 0.561249 -0.846178
C -3.095020 -1.528958 -1.192198
C -3.929950 0.294549 0.366680
C -0.306406 0.328139 -0.364838
C -0.140154 0.330308 1.150706
C -1.844155 -2.342488 -1.589489
C -3.896240 -1.108406 -2.459466
C -3.493186 1.137982 1.589670
C -5.006894 -0.711049 0.835097
C 1.819003 1.633452 -0.791812
C 2.272537 -0.287097 1.005367
C 2.649824 0.635536 -0.024280
C 3.248735 -1.141026 1.589404
C 4.034018 0.668762 -0.393646
C 4.589165 -1.096540 1.183752
C 4.991377 -0.176550 0.181420
H -1.740714 0.531621 -1.954428
H -2.032536 1.599763 -0.584408
H -3.731205 -2.208938 -0.598987
H -4.410391 0.990925 -0.366911
H 0.089003 -0.621862 -0.769812
H -0.038648 1.366243 1.531906
H -1.001292 -0.170489 1.616078
H -2.151811 -3.257525 -2.127738
H -1.176922 -1.776847 -2.265923
H -1.272772 -2.644534 -0.693767
H -4.819559 -0.559678 -2.198461
H -4.188975 -2.003623 -3.038724
H -3.294654 -0.464457 -3.127509
H -4.360743 1.699533 1.982001
H -3.114978 0.480289 2.393927
H -2.709198 1.876238 1.347032
H -5.521555 -1.215805 -0.000123
H -5.775424 -0.170897 1.416383
H -4.559679 -1.479887 1.492431
H 2.909506 -1.824763 2.373228
H 4.319731 1.399150 -1.156821
H 5.319841 -1.766580 1.649578
H 6.035673 -0.123955 -0.141142


