%chk=000284702.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000284702

0 1
O 2.055686 1.105690 0.980704
O 2.822107 2.363753 -1.806720
O 2.886730 -1.072852 -1.443120
O 3.915765 -2.038741 0.820931
O -3.096572 -2.784160 -0.141631
N 0.049415 0.641348 -0.180928
N -1.590645 2.330746 0.666668
N -3.827916 1.406630 1.016487
N -1.148333 -3.491143 -1.041512
C 1.278386 1.458379 -0.171847
C 2.154004 1.164286 -1.426359
C 3.259480 0.203816 -0.920075
C 3.189254 0.268871 0.628050
C 2.968797 -1.083363 1.322275
C -1.216423 1.074667 0.269974
C -0.052047 -0.736036 -0.489434
C -2.111469 -0.048979 0.211920
C -1.349204 -1.172736 -0.273982
C -3.445310 0.178268 0.612711
C -1.951129 -2.504504 -0.464582
C -2.895247 2.427313 1.025857
H 1.022572 2.538802 -0.013683
H 1.591058 0.733471 -2.282060
H 4.260650 0.482051 -1.314817
H 4.059982 0.817344 1.051387
H 1.986509 -1.527784 1.063785
H 3.043236 -0.996270 2.419709
H 0.816732 -1.281419 -0.851606
H 2.293960 2.857597 -2.473239
H 3.471599 -1.787529 -1.052928
H 4.799737 -1.894904 1.218426
H -4.189169 -0.635460 0.603818
H -3.255470 3.414321 1.359783
H -0.223992 -3.329016 -1.390746
H -1.537534 -4.407858 -1.204819


%chk=000284702-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000284702

0 1
O 1.997437 0.839043 1.102596
O 2.833498 2.348119 -1.573025
O 2.724961 -1.263519 -1.241546
O 4.526812 -1.869714 0.697688
O -3.425123 -2.755547 -0.335645
N -0.061893 0.497966 -0.129194
N -1.583514 2.292800 0.585145
N -3.925462 1.593311 0.797062
N -1.386133 -3.541156 -1.117221
C 1.184257 1.262401 -0.055251
C 2.099392 1.107353 -1.308147
C 3.179464 0.087288 -0.896901
C 3.307586 0.307231 0.636784
C 3.575329 -0.992981 1.424816
C -1.319250 1.015311 0.219977
C -0.220509 -0.856360 -0.458090
C -2.283040 -0.040609 0.101692
C -1.565757 -1.224513 -0.336695
C -3.618436 0.315760 0.414102
C -2.195900 -2.544034 -0.589152
C -2.904722 2.509910 0.861114
H 0.876540 2.310325 0.115358
H 1.532183 0.766107 -2.194261
H 4.121571 0.326416 -1.422467
H 4.076756 1.079715 0.832498
H 2.641311 -1.570283 1.490518
H 3.936736 -0.781407 2.446689
H 0.665562 -1.423219 -0.752824
H 2.200275 3.065498 -1.827947
H 3.421839 -1.879986 -0.870891
H 5.458304 -1.576551 0.848344
H -4.432466 -0.411514 0.360958
H -3.179500 3.523321 1.166436
H -0.413894 -3.389224 -1.377656
H -1.809017 -4.452659 -1.286465


