%chk=000184237.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184237

0 1
O -0.028055 -0.216090 -1.888925
N 1.408467 0.309759 -0.216649
N 3.638766 0.763785 -0.285739
C -2.055003 1.035068 0.130883
C -1.020379 -0.130582 0.336560
C -1.649454 -1.531980 0.217319
C -1.289076 2.370418 0.111003
C -3.032645 1.030913 1.319641
C -2.828869 0.865874 -1.182461
C 0.088148 -0.033623 -0.699057
C -0.743314 -2.588617 0.781084
C 1.830981 0.588863 1.113866
C 2.581987 0.434938 -1.032066
C -0.205324 -3.560922 0.048718
C 3.184756 0.861776 1.048386
H -0.607191 -0.019861 1.371682
H -1.902834 -1.742106 -0.845287
H -2.619766 -1.550918 0.759945
H -1.981380 3.220954 0.119878
H -0.630166 2.487519 0.976886
H -0.675612 2.482231 -0.790936
H -3.804318 1.799709 1.194261
H -3.550982 0.070013 1.417977
H -2.527765 1.234099 2.269198
H -2.152795 0.697798 -2.034329
H -3.519860 0.017785 -1.150408
H -3.422972 1.756490 -1.414094
H -0.557915 -2.509059 1.853461
H 1.157622 0.564826 1.948576
H 2.550827 0.271385 -2.102443
H 0.439242 -4.325214 0.460402
H -0.359653 -3.670593 -1.016378
H 3.870231 1.118462 1.838246


%chk=000184237-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000184237

0 1
O 0.025375 -0.340805 -1.877963
N 1.427724 0.332348 -0.157656
N 3.641561 0.856920 -0.274325
C -2.040598 1.035232 0.125836
C -1.023653 -0.169817 0.330608
C -1.673321 -1.582987 0.177372
C -1.255508 2.375352 0.062172
C -2.992684 1.086043 1.352575
C -2.871655 0.870323 -1.173043
C 0.142995 -0.078160 -0.654550
C -0.784753 -2.682245 0.724527
C 1.838716 0.672440 1.155837
C 2.573782 0.466418 -0.976569
C -0.238485 -3.679817 -0.014659
C 3.185854 0.986889 1.062219
H -0.642034 -0.081354 1.365241
H -1.888751 -1.765964 -0.889180
H -2.636457 -1.583645 0.723381
H -1.963655 3.223564 0.029976
H -0.605553 2.514403 0.946855
H -0.622665 2.437899 -0.841791
H -3.707693 1.921715 1.238469
H -3.584419 0.159397 1.462003
H -2.430658 1.249115 2.292218
H -2.220248 0.752731 -2.056121
H -3.539606 -0.008024 -1.121547
H -3.505689 1.763896 -1.323933
H -0.578983 -2.642511 1.806835
H 1.170108 0.655966 2.009387
H 2.535875 0.259498 -2.041864
H 0.400237 -4.447025 0.437208
H -0.412215 -3.751191 -1.095338
H 3.862757 1.296493 1.855020


