%chk=000237117.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237117

0 1
O 2.348850 -1.297831 -0.970157
O -2.537743 -2.219003 0.481278
N -0.310543 -0.183125 1.010339
N -1.066349 1.901924 1.816682
N 1.638174 3.857907 -0.571767
N -0.158549 4.066520 1.140065
N 2.266326 2.827771 -1.237225
C 0.201900 -1.033284 -0.093355
C -1.287824 -0.844716 1.917294
C -0.235094 1.197795 0.960720
C 1.602995 -1.569645 0.240547
C -2.670700 -1.014968 1.275194
C 0.682376 1.925411 0.146802
C 0.665239 3.363478 0.290916
C 1.716356 1.669592 -0.822872
C 3.769541 -1.589445 -0.870410
C -3.707689 -2.524338 -0.322770
C -0.979382 3.269673 1.866546
C 4.346833 -1.031572 -2.158280
C -3.315421 -3.781145 -1.078835
H 0.239688 -0.472230 -1.059308
H -0.516613 -1.876222 -0.271338
H -1.381517 -0.252153 2.860345
H -0.878702 -1.845610 2.192962
H 1.605209 -2.656845 0.422481
H 2.070823 -1.045804 1.093086
H -2.947049 -0.163320 0.629535
H -3.454463 -1.173309 2.036235
H 2.049333 0.696073 -1.188466
H 1.897136 4.819936 -0.735096
H 3.890201 -2.683627 -0.789419
H 4.182374 -1.095778 0.026325
H -3.913364 -1.673066 -0.994880
H -4.566600 -2.687769 0.351202
H -1.665939 3.766106 2.573550
H 5.400403 -1.305241 -2.278469
H 3.794963 -1.407107 -3.031617
H 4.275294 0.064892 -2.190686
H -4.141080 -4.152414 -1.695322
H -2.454188 -3.599262 -1.735007
H -3.019703 -4.581048 -0.386025


%chk=000237117-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000237117

0 1
O 2.601421 -1.394392 -0.994785
O -2.478041 -2.163750 0.308640
N -0.310652 -0.196889 0.962441
N -1.146359 1.775569 1.931606
N 1.112769 4.067248 -0.574945
N -0.547350 4.048045 1.233035
N 1.856485 3.162438 -1.339493
C 0.427432 -0.938201 -0.078255
C -1.128241 -0.963895 1.928411
C -0.319565 1.181457 0.999126
C 1.919404 -1.123676 0.273096
C -2.557185 -1.231727 1.440781
C 0.470901 2.027422 0.134331
C 0.277517 3.440565 0.325859
C 1.466139 1.932603 -0.908027
C 4.038207 -1.672105 -0.821591
C -3.793448 -2.439345 -0.289747
C -1.209155 3.137812 1.999086
C 4.635463 -1.894209 -2.210133
C -3.582829 -3.413588 -1.448028
H 0.358149 -0.403325 -1.040605
H -0.070702 -1.909039 -0.220731
H -1.183102 -0.391236 2.868273
H -0.625216 -1.930006 2.115439
H 2.063760 -1.966237 0.984679
H 2.327142 -0.201656 0.741516
H -3.041389 -0.280440 1.137749
H -3.151767 -1.683875 2.266802
H 1.928203 1.056052 -1.361288
H 1.235063 5.067630 -0.714442
H 4.165800 -2.572255 -0.180367
H 4.524093 -0.812570 -0.308776
H -4.248008 -1.487966 -0.644778
H -4.469080 -2.874614 0.480528
H -1.880446 3.544759 2.761951
H 5.715684 -2.114781 -2.133970
H 4.138426 -2.741395 -2.713260
H 4.504755 -0.994407 -2.835454
H -4.547116 -3.649170 -1.933885
H -2.908170 -2.975040 -2.203532
H -3.133492 -4.354609 -1.086460


