%chk=000213140.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213140

0 1
O 2.000040 -0.182156 -1.138899
N -0.896122 -0.071422 0.611758
N -3.743603 -0.378058 0.062417
C 0.287403 0.432415 1.399045
C -1.716076 1.061771 0.065591
C -1.771964 -0.946566 1.461398
C -2.871698 0.499076 -0.785452
C -2.920258 -1.511495 0.601372
C 1.224066 -0.733157 1.807682
C 1.087064 1.417087 0.576718
C -4.912290 -0.908416 -0.718580
C 1.382566 -1.754928 0.727193
C 1.858884 1.053682 -0.530733
C 1.081906 2.773773 0.957283
C 1.672422 -1.421475 -0.604401
C -5.921788 0.210005 -0.981456
C 1.813311 3.733884 0.257249
C 2.609045 2.012425 -1.253997
C 1.205606 -3.117772 1.027674
C 2.580479 3.339992 -0.859929
C 1.763674 -2.399901 -1.617214
C 1.309400 -4.099366 0.042892
C 1.796434 5.169275 0.672248
C 1.581286 -3.737194 -1.283647
H -0.048814 0.939929 2.346244
H -1.066266 1.686217 -0.586177
H -2.122790 1.720443 0.862832
H -2.192594 -0.409868 2.339484
H -1.163701 -1.794682 1.841566
H -3.487136 1.342654 -1.163771
H -2.456528 -0.032901 -1.669862
H -2.498037 -2.158735 -0.199060
H -3.571800 -2.146739 1.237552
H 0.843880 -1.202268 2.737289
H 2.219817 -0.318883 2.079506
H -5.399883 -1.699665 -0.105990
H -4.612929 -1.385756 -1.676780
H 0.486706 3.075319 1.819347
H -6.128683 0.772993 -0.060620
H -5.556734 0.928493 -1.723010
H -6.870395 -0.195976 -1.346828
H 3.193845 1.683029 -2.112144
H 0.984543 -3.411842 2.053202
H 3.153959 4.083375 -1.412019
H 1.975376 -2.088066 -2.638088
H 1.174744 -5.146476 0.301890
H 1.427434 5.814164 -0.138100
H 1.156102 5.352181 1.544488
H 2.805116 5.519256 0.934780
H 1.649783 -4.502876 -2.054742


%chk=000213140-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213140

0 1
O 1.854957 -0.208959 -1.216648
N -0.950849 -0.020907 0.587869
N -3.798269 -0.381827 0.041669
C 0.246943 0.452052 1.345476
C -1.806356 1.100927 0.117521
C -1.774327 -0.988814 1.356815
C -2.974878 0.579116 -0.732470
C -2.942178 -1.503349 0.500225
C 1.152984 -0.734213 1.795924
C 1.067564 1.443748 0.532914
C -4.988119 -0.869885 -0.701988
C 1.391518 -1.782181 0.721816
C 1.809956 1.066282 -0.614820
C 1.139594 2.798972 0.946225
C 1.681397 -1.484629 -0.636128
C -6.034894 0.228389 -0.964890
C 1.885944 3.781072 0.255832
C 2.553515 2.032889 -1.334878
C 1.305181 -3.154983 1.076948
C 2.591793 3.370985 -0.906333
C 1.870091 -2.518860 -1.585335
C 1.500689 -4.195723 0.146189
C 1.931084 5.223101 0.730839
C 1.781075 -3.869438 -1.201323
H -0.072630 0.983501 2.281210
H -1.193621 1.788368 -0.489917
H -2.222969 1.679499 0.981686
H -2.183923 -0.521459 2.289074
H -1.150545 -1.852325 1.642563
H -3.602357 1.436461 -1.033597
H -2.563235 0.106104 -1.661142
H -2.518601 -2.078749 -0.362310
H -3.558098 -2.196064 1.104707
H 0.708290 -1.233482 2.675954
H 2.108339 -0.295566 2.143336
H -5.451844 -1.664645 -0.085653
H -4.695094 -1.347094 -1.674541
H 0.572615 3.089936 1.840327
H -6.308821 0.727339 -0.018567
H -5.667187 0.997206 -1.667860
H -6.946886 -0.213506 -1.406727
H 3.099768 1.702999 -2.223911
H 1.078818 -3.401442 2.122517
H 3.178885 4.102858 -1.474206
H 2.089693 -2.232144 -2.618236
H 1.430821 -5.241213 0.464180
H 1.569539 5.917660 -0.050832
H 1.305511 5.373282 1.627525
H 2.962545 5.531775 0.986482
H 1.931373 -4.658267 -1.946311


