%chk=000246023.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246023

0 1
N 0.080698 -1.374182 0.222499
N -0.029037 0.000269 0.479693
C -0.020949 -2.047178 -1.027095
C 0.338910 -2.317578 1.251057
C -1.298625 0.564948 0.030364
C 1.181444 0.779482 0.259456
C 0.158409 -3.398306 -0.762721
C 0.382192 -3.565372 0.640900
C -0.289264 -1.348761 -2.299060
C 0.525462 -1.934114 2.664050
C -1.365291 1.646002 -0.864255
C 1.199171 2.078024 0.809714
C -2.474836 0.022622 0.581892
C 2.327948 0.259412 -0.361741
C -2.608973 2.199199 -1.178551
C 2.360532 2.843907 0.723095
C -3.708429 0.583178 0.249588
C 3.484058 1.041612 -0.434305
C -3.780026 1.672767 -0.625720
C 3.505208 2.332052 0.100235
H 0.134111 -4.193407 -1.479291
H 0.552698 -4.502591 1.128771
H 0.404589 -0.513133 -2.472503
H -0.192611 -2.034702 -3.153788
H -1.311997 -0.938614 -2.328047
H 1.486805 -1.416615 2.813497
H -0.260827 -1.245155 3.010116
H 0.514605 -2.813289 3.322863
H -0.461064 2.056834 -1.312108
H 0.315209 2.473915 1.309073
H -2.418547 -0.828780 1.261519
H 2.334279 -0.749535 -0.776120
H -2.663259 3.043759 -1.865041
H 2.376789 3.847165 1.148307
H -4.621167 0.168059 0.676853
H 4.374902 0.636373 -0.914183
H -4.745536 2.106876 -0.877064
H 4.407620 2.935656 0.037551


%chk=000246023-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246023

0 1
N 0.098958 -1.353036 -0.003832
N 0.001045 0.048493 -0.014576
C -0.008772 -2.171820 -1.151316
C 0.307983 -2.131853 1.157867
C -1.315670 0.605630 -0.103385
C 1.226116 0.784059 0.084629
C 0.136708 -3.487421 -0.701506
C 0.335338 -3.462404 0.730177
C -0.251620 -1.600404 -2.517930
C 0.471250 -1.510182 2.514379
C -1.534398 1.882703 -0.690392
C 1.262005 2.075183 0.680302
C -2.431617 -0.149721 0.349784
C 2.438996 0.194680 -0.365703
C -2.842733 2.399673 -0.788328
C 2.485215 2.768297 0.790656
C -3.734934 0.377151 0.237213
C 3.655821 0.896643 -0.240622
C -3.953134 1.657254 -0.322464
C 3.690827 2.190775 0.328295
H 0.101775 -4.371428 -1.337116
H 0.484118 -4.323769 1.380233
H 0.494431 -0.827231 -2.784091
H -0.190392 -2.405255 -3.268907
H -1.250617 -1.131267 -2.603328
H 1.406197 -0.923079 2.595792
H -0.363885 -0.827118 2.761669
H 0.501487 -2.302178 3.280765
H -0.690994 2.455503 -1.086447
H 0.345648 2.522627 1.075792
H -2.275392 -1.146924 0.772905
H 2.425675 -0.812158 -0.794583
H -2.994070 3.383656 -1.246602
H 2.495380 3.760477 1.256064
H -4.583678 -0.218270 0.592019
H 4.581126 0.427152 -0.593088
H -4.966681 2.063379 -0.404481
H 4.637688 2.732984 0.419655


