%chk=000272127.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272127

0 1
N 0.944056 0.019976 0.126427
C -1.804112 -0.561585 0.305835
C 0.027569 1.024567 0.240822
C 0.504449 -1.272859 0.103168
C -1.356617 0.766175 0.332184
C -0.864750 -1.597174 0.194315
C -3.237088 -0.886081 0.406688
C 0.520292 2.412801 0.269539
C 1.508406 -2.343783 -0.022770
C -4.186572 -0.248993 -0.291913
C -5.619311 -0.575955 -0.204680
C 1.777926 2.762097 -0.042057
C 2.828837 -2.144900 0.110092
C 2.265327 4.150636 -0.021556
C 3.828957 -3.218215 -0.007311
C -6.229924 -0.837897 1.032788
C -6.390421 -0.613562 -1.379910
C 1.917255 5.029126 1.017682
C 3.105984 4.599596 -1.055674
C 3.733113 -4.196013 -1.011123
C 4.906922 -3.255276 0.895068
C -7.593596 -1.137742 1.091415
C -7.751067 -0.920061 -1.314528
C 2.400279 6.340496 1.018172
C 3.579112 5.913172 -1.052872
C 4.700719 -5.199842 -1.106363
C 5.866155 -4.265197 0.798803
C -8.355493 -1.181771 -0.079989
C 3.228365 6.785619 -0.016581
C 5.765865 -5.238424 -0.201626
H -2.064499 1.584790 0.427067
H -1.187070 -2.634495 0.174301
H -3.476330 -1.708149 1.087342
H -0.224674 3.159191 0.556258
H 1.098583 -3.336655 -0.224261
H -3.937355 0.554200 -0.992797
H 2.517672 2.008238 -0.342576
H 3.232876 -1.147054 0.326632
H -5.642069 -0.798880 1.948344
H -5.924812 -0.410847 -2.342915
H 1.278449 4.684309 1.829203
H 3.382702 3.923254 -1.863090
H 2.909054 -4.165433 -1.722117
H 4.989470 -2.498789 1.674079
H -8.063027 -1.337571 2.053488
H -8.343612 -0.954127 -2.227570
H 2.130187 7.016557 1.827818
H 4.224678 6.258630 -1.858827
H 4.623632 -5.953568 -1.888332
H 6.695750 -4.293926 1.503504
H -9.416722 -1.417731 -0.032137
H 3.601247 7.807849 -0.015588
H 6.516731 -6.022423 -0.275968


%chk=000272127-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272127

0 1
N 0.908628 -0.016398 -0.006035
C -1.895188 -0.636169 0.002789
C -0.036114 0.981967 -0.009676
C 0.478687 -1.318421 0.001782
C -1.430890 0.707920 -0.005111
C -0.904577 -1.654011 0.005938
C -3.315302 -1.019626 0.007645
C 0.428097 2.379724 -0.018726
C 1.484728 -2.393027 0.005942
C -4.388553 -0.167963 0.005629
C -5.812108 -0.541047 0.010579
C 1.748186 2.741833 -0.027162
C 2.836141 -2.173801 0.006231
C 2.298487 4.104839 -0.037030
C 3.899553 -3.188746 0.010323
C -6.269996 -1.892225 0.016531
C -6.790587 0.495421 0.009162
C 1.490206 5.280818 -0.041719
C 3.714455 4.269061 -0.042631
C 3.645067 -4.593011 0.015678
C 5.258166 -2.757227 0.008978
C -7.646558 -2.187854 0.021034
C -8.169717 0.200149 0.013708
C 2.076511 6.561071 -0.051310
C 4.302982 5.550818 -0.052186
C 4.704746 -5.520009 0.019317
C 6.320637 -3.684954 0.012611
C -8.605599 -1.144741 0.019695
C 3.486249 6.705108 -0.056574
C 6.049427 -5.072767 0.017783
H -2.134152 1.546982 -0.008133
H -1.203391 -2.708962 0.012057
H -3.496511 -2.103572 0.013759
H -0.363442 3.140949 -0.018763
H 1.083208 -3.415129 0.009265
H -4.198509 0.915048 0.000084
H 2.473345 1.916339 -0.026276
H 3.155330 -1.122437 0.002747
H -5.547996 -2.716068 0.017426
H -6.458334 1.541315 0.004509
H 0.398067 5.192563 -0.038130
H 4.351352 3.375831 -0.039346
H 2.612962 -4.960641 0.017074
H 5.472548 -1.681349 0.004945
H -7.977988 -3.232384 0.025503
H -8.902340 1.014743 0.012548
H 1.438026 7.451910 -0.054915
H 5.394154 5.650674 -0.056270
H 4.488043 -6.594356 0.023471
H 7.356783 -3.328538 0.011446
H -9.675681 -1.379318 0.023168
H 3.938680 7.702928 -0.064132
H 6.871581 -5.796960 0.020670


