%chk=000258411.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258411

0 1
O -0.201766 1.535186 -0.789291
O -2.309899 -2.551424 -0.191025
N 1.748207 -0.718923 0.237118
N -1.555445 -0.338919 -0.383999
N 0.756371 -2.675829 0.494153
N 1.660011 -1.923143 0.904360
C 0.763052 -0.719098 -0.902992
C 0.050942 -2.094136 -0.703743
C -0.331900 0.346876 -0.676893
C -1.417308 -1.776939 -0.375763
C 2.959039 0.061525 0.216467
C -2.799835 0.342882 -0.077989
C 2.938437 1.323860 -0.401966
C 4.121916 -0.416989 0.846158
C -3.725077 -0.259235 0.791159
C -3.064613 1.595092 -0.657166
C 4.099003 2.099976 -0.392875
C 5.267729 0.380818 0.847297
C -4.922464 0.402034 1.072094
C -4.266214 2.241074 -0.357823
C 5.263663 1.633492 0.225271
C -5.196591 1.649436 0.502144
H 1.253885 -0.575915 -1.890341
H 0.119035 -2.803595 -1.559742
H 2.026198 1.717902 -0.856998
H 4.132220 -1.389615 1.339316
H -3.525755 -1.236572 1.235517
H -2.339874 2.072663 -1.318817
H 4.090155 3.081596 -0.868110
H 6.172152 0.019218 1.337712
H -5.645979 -0.061858 1.743013
H -4.475617 3.214999 -0.800517
H 6.162966 2.246448 0.227473
H -6.131445 2.158813 0.728499


%chk=000258411-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258411

0 1
O -0.169371 1.575546 -0.862228
O -2.368573 -2.561948 -0.417149
N 1.802448 -0.809384 0.007794
N -1.537789 -0.323618 -0.428086
N 0.700557 -2.738624 0.381759
N 1.665204 -1.969506 0.782581
C 0.753491 -0.738754 -1.049201
C 0.030797 -2.090040 -0.854223
C -0.330265 0.337954 -0.772565
C -1.431851 -1.752142 -0.543313
C 2.945600 0.030546 0.147857
C -2.765255 0.353909 -0.070958
C 3.010586 1.262602 -0.551524
C 4.021962 -0.378722 0.980330
C -3.581120 -0.188458 0.951438
C -3.141165 1.542631 -0.741438
C 4.162799 2.069216 -0.429705
C 5.156387 0.447508 1.099656
C -4.781239 0.466482 1.298542
C -4.340844 2.190747 -0.377868
C 5.240087 1.671489 0.392916
C -5.164922 1.656754 0.638774
H 1.208223 -0.566177 -2.038899
H 0.087540 -2.813924 -1.680925
H 2.159182 1.610326 -1.144028
H 3.957766 -1.328944 1.516155
H -3.288567 -1.110764 1.459237
H -2.503014 1.961920 -1.522204
H 4.205947 3.020608 -0.970921
H 5.983391 0.128306 1.743419
H -5.413881 0.045820 2.087115
H -4.630452 3.112743 -0.892947
H 6.127972 2.305149 0.487719
H -6.096432 2.162449 0.914591


