%chk=000223757.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223757

0 1
N -2.442887 0.940235 0.024036
N 2.188284 0.053253 -0.088381
N -1.747971 -1.464586 -0.236942
N 0.678907 -1.762555 -0.278101
N -1.762043 2.141955 0.152680
C -0.213506 0.478382 -0.029464
C -1.523912 -0.119130 -0.091125
C 0.897705 -0.407989 -0.131154
C -0.617053 -2.225149 -0.317435
C 3.350196 -0.869885 -0.196161
C -0.441877 1.888072 0.123387
C -3.884587 0.917058 0.020732
C -0.795562 -3.716203 -0.465584
C 4.626036 -0.077833 -0.076198
C -4.569359 -0.308107 -0.037545
C -4.593402 2.133580 0.077219
C -0.920878 -4.374471 0.906108
C 5.252063 0.425076 -1.225809
C 5.189425 0.159559 1.185948
C -5.966387 -0.306271 -0.040265
C -5.987786 2.110170 0.074389
C -6.678814 0.894680 0.015491
C 6.438152 1.155600 -1.111880
C 6.375409 0.890846 1.294732
C 7.000941 1.388971 0.147111
H 2.377197 1.044190 0.015309
H 3.294991 -1.425086 -1.164850
H 3.275043 -1.656662 0.594971
H 0.300641 2.665813 0.206978
H -1.701119 -3.924792 -1.076455
H 0.067207 -4.144992 -1.020760
H -4.029915 -1.259815 -0.082532
H -4.059382 3.085065 0.123831
H -0.024632 -4.202842 1.516116
H -1.056386 -5.457667 0.810634
H -1.781363 -3.978936 1.462323
H 4.816679 0.245636 -2.208248
H 4.704784 -0.227000 2.081907
H -6.500502 -1.255185 -0.086429
H -6.540246 3.048380 0.118162
H -7.766559 0.885573 0.013076
H 6.924848 1.542827 -2.006134
H 6.813244 1.071850 2.275572
H 7.925878 1.957187 0.233743


%chk=000223757-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000223757

0 1
N -2.459556 0.985990 0.209842
N 2.095967 0.159836 1.129079
N -1.626402 -1.315506 -0.239256
N 0.748266 -1.585796 0.285773
N -1.913250 2.193483 0.694306
C -0.275615 0.576152 0.645377
C -1.487939 -0.016067 0.169074
C 0.870509 -0.285645 0.691807
C -0.472530 -2.041889 -0.155524
C 3.302112 -0.683427 1.198437
C -0.608436 1.935417 0.950240
C -3.848814 0.950158 -0.149087
C -0.535526 -3.500562 -0.551854
C 4.477174 -0.091227 0.427200
C -4.430370 -0.240053 -0.654690
C -4.628089 2.123421 0.010005
C -0.509423 -4.430483 0.690307
C 4.313169 0.349396 -0.911611
C 5.756123 0.004009 1.028141
C -5.799137 -0.242704 -0.998538
C -5.993574 2.099424 -0.339195
C -6.588561 0.919579 -0.844818
C 5.408119 0.870972 -1.633859
C 6.855548 0.522889 0.305625
C 6.684374 0.958725 -1.027768
H 2.182682 1.139467 1.401532
H 3.002422 -1.663002 0.784031
H 3.590610 -0.843010 2.256361
H 0.013318 2.741270 1.338374
H -1.459487 -3.664871 -1.131117
H 0.332883 -3.731568 -1.195480
H -3.812519 -1.133835 -0.768760
H -4.155841 3.027077 0.400961
H 0.408521 -4.259572 1.279454
H -0.534449 -5.490578 0.380277
H -1.382063 -4.240416 1.340490
H 3.326146 0.279303 -1.383903
H 5.894027 -0.329258 2.064679
H -6.247978 -1.162765 -1.389360
H -6.594090 3.007442 -0.215237
H -7.650198 0.907441 -1.114425
H 5.269665 1.205544 -2.668161
H 7.839635 0.590485 0.782900
H 7.534077 1.363558 -1.588628


