%chk=000242587.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242587

0 1
O 0.557365 -0.686115 0.034877
O -3.734191 1.720760 -0.490889
O -3.716209 -2.773016 0.169480
O -0.982855 3.082563 0.185071
N 5.099475 0.486314 0.440781
C -1.439939 0.754397 -0.105944
C -0.824464 -0.516230 0.003048
C -2.860651 0.723759 -0.231844
C 1.375984 0.441625 -0.049912
C -0.586639 1.944883 0.007999
C -1.489048 -1.735175 0.095970
C -2.895298 -1.689882 0.061447
C 0.866085 1.681606 -0.073660
C -3.579900 -0.484847 -0.116320
C 2.779636 0.017843 -0.092401
C 3.152826 -1.198977 -0.688736
C 3.790041 0.831760 0.469247
C 4.500725 -1.558520 -0.718792
C -3.330000 3.066859 -0.853016
C 5.445491 -0.690051 -0.146660
C -3.110455 -4.079555 0.357011
H -0.929812 -2.656858 0.194392
H 1.490534 2.573561 -0.141581
H -4.668090 -0.470929 -0.178590
H 2.388215 -1.850113 -1.120128
H 3.549067 1.785048 0.959761
H 4.816895 -2.493896 -1.176508
H -4.272176 3.474464 -1.239076
H -2.548750 3.052379 -1.616020
H -2.992922 3.597800 0.049350
H 6.516978 -0.927946 -0.148184
H -2.535357 -4.100210 1.287376
H -2.498905 -4.340091 -0.511384
H -3.996659 -4.725110 0.425535


%chk=000242587-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242587

0 1
O 0.562315 -0.706730 -0.093073
O -3.684158 1.926370 0.067319
O -3.805443 -2.777538 0.050598
O -0.944095 3.126111 0.510462
N 5.192805 0.699884 -0.288008
C -1.434191 0.769591 0.035976
C -0.837696 -0.528533 -0.034808
C -2.881928 0.788879 0.037090
C 1.415956 0.403153 -0.015002
C -0.543224 1.941037 0.239986
C -1.553650 -1.738558 -0.039861
C -2.962026 -1.667847 0.032785
C 0.897122 1.662542 0.154275
C -3.613697 -0.412666 0.056742
C 2.837820 0.019199 -0.109462
C 3.231903 -1.346508 -0.106511
C 3.867712 0.998473 -0.210557
C 4.601115 -1.669355 -0.190518
C -3.448561 3.042067 -0.877811
C 5.545992 -0.621594 -0.274093
C -3.187824 -4.107738 -0.004714
H -1.000358 -2.677973 -0.089178
H 1.556467 2.525765 0.267037
H -4.704766 -0.366717 0.065413
H 2.470423 -2.127328 -0.036753
H 3.627824 2.067011 -0.239432
H 4.934400 -2.711612 -0.188307
H -4.403183 3.589888 -0.894155
H -3.221284 2.647920 -1.886556
H -2.626220 3.674943 -0.510879
H 6.619984 -0.829071 -0.334348
H -2.528340 -4.277318 0.867682
H -2.614697 -4.243414 -0.941824
H -4.029501 -4.814235 0.022187


