%chk=000268614.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268614

0 1
N -1.622079 1.899231 0.109300
C -1.283126 -0.475777 0.370937
C -1.677153 -1.461142 -0.741580
C -2.239939 0.755151 0.279882
C 0.047831 0.228641 0.134339
C -3.181870 -1.771271 -0.705478
C -3.709276 0.528680 0.276126
C -4.044770 -0.505087 -0.815143
C -1.328641 -1.096836 1.765368
C -0.208767 1.605427 0.030139
C 1.368968 -0.264782 0.045716
C 2.415543 0.686459 -0.146724
C 0.825094 2.550728 -0.157794
C 2.117296 2.082110 -0.242181
C 1.698140 -1.656872 0.134718
C 3.766166 0.215554 -0.242355
C 3.000544 -2.071660 0.038649
C 4.049817 -1.122435 -0.152127
H -1.092266 -2.394710 -0.647101
H -1.403092 -1.032341 -1.726795
H -3.429755 -2.312949 0.228081
H -3.433710 -2.462044 -1.533208
H -4.039467 0.168698 1.272495
H -4.261116 1.475662 0.094789
H -5.116280 -0.772270 -0.752938
H -3.901350 -0.041411 -1.812055
H -0.582207 -1.893483 1.869665
H -1.111325 -0.351415 2.541791
H -2.311658 -1.529104 1.982961
H 0.580518 3.609109 -0.231301
H 2.942981 2.779042 -0.386180
H 0.889055 -2.371350 0.278764
H 4.561286 0.945733 -0.388574
H 3.259067 -3.127194 0.105157
H 5.073843 -1.484292 -0.224141


%chk=000268614-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268614

0 1
N -1.625632 1.894895 0.084188
C -1.288236 -0.480065 0.367593
C -1.725528 -1.478878 -0.759122
C -2.233248 0.736532 0.292949
C 0.052130 0.215717 0.126657
C -3.248224 -1.771857 -0.721976
C -3.719152 0.541453 0.302547
C -4.095844 -0.480133 -0.817152
C -1.347810 -1.131894 1.782237
C -0.214489 1.596065 0.000675
C 1.389835 -0.277086 0.051101
C 2.452963 0.700542 -0.149412
C 0.817221 2.554660 -0.197168
C 2.135436 2.097997 -0.266712
C 1.747604 -1.665621 0.151251
C 3.809638 0.244966 -0.230531
C 3.080689 -2.073344 0.067115
C 4.123223 -1.111788 -0.123338
H -1.152295 -2.421353 -0.665290
H -1.463371 -1.037320 -1.740626
H -3.508495 -2.319217 0.206087
H -3.503345 -2.445244 -1.562981
H -4.048358 0.133234 1.280059
H -4.226215 1.509186 0.150538
H -5.173317 -0.721330 -0.749149
H -3.928946 -0.002971 -1.803156
H -0.633447 -1.971133 1.853754
H -1.083892 -0.394509 2.560530
H -2.357053 -1.521341 2.004506
H 0.564264 3.614933 -0.289151
H 2.957590 2.807945 -0.416296
H 0.960498 -2.414330 0.287103
H 4.604919 0.985256 -0.380740
H 3.334584 -3.136539 0.144332
H 5.164606 -1.445628 -0.187219


