%chk=000207514.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207514

0 1
O 5.975221 0.922902 -1.421108
O 6.055439 1.749611 0.708469
N 1.910538 -0.201048 0.115343
N 4.031720 1.688580 -0.471438
N -3.564482 -1.351374 0.446528
N -1.168741 -1.344970 0.460550
N 0.038720 -2.119885 -1.488799
N -2.410838 -1.924061 -1.565792
N -1.179734 -2.614186 -3.461164
C 2.675587 0.435020 1.237411
C 2.787980 -0.404380 -1.083171
C 3.209216 1.804389 0.768242
C 3.313522 0.963876 -1.558224
C 1.287628 -1.488911 0.555000
C -4.833805 -1.250341 -0.328644
C -5.099392 0.199129 -0.760213
C -3.582439 -0.540735 1.698351
C -4.943829 1.167451 0.378642
C -4.206850 0.824029 1.527160
C -0.018048 -1.645913 -0.205552
C -2.362065 -1.500915 -0.245676
C 5.405157 1.445857 -0.272627
C -5.521116 2.443184 0.282873
C -4.059604 1.757897 2.563504
C -5.370722 3.366446 1.318978
C -4.639233 3.023804 2.461043
C -1.187231 -2.221805 -2.139512
C 7.435468 0.820859 -1.438932
C 7.883202 -0.369027 -0.616136
H 3.512803 -0.192831 1.610563
H 1.975720 0.592187 2.088221
H 2.168144 -0.864211 -1.889514
H 3.635082 -1.097414 -0.894714
H 3.811796 2.282373 1.574117
H 2.360564 2.487684 0.530585
H 2.463668 1.612961 -1.875253
H 3.985410 0.839223 -2.436650
H 1.926154 -2.385232 0.380260
H 1.063644 -1.459224 1.648867
H -4.796382 -1.924993 -1.215099
H -5.650089 -1.621963 0.331160
H -4.390522 0.481384 -1.572124
H -6.110293 0.273079 -1.208115
H -4.164792 -1.126614 2.450994
H -2.545514 -0.443022 2.110733
H -6.088007 2.716389 -0.605272
H -3.486141 1.498317 3.452343
H -5.821484 4.353859 1.236967
H -4.519052 3.743864 3.268058
H 7.859879 1.773317 -1.074145
H 7.613602 0.696907 -2.522794
H -0.323997 -2.946061 -3.877400
H -2.049394 -2.815359 -3.928441
H 7.356623 -1.285375 -0.908758
H 7.679964 -0.203400 0.454096
H 8.958946 -0.549127 -0.722291


%chk=000207514-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207514

0 1
O 6.329907 0.879450 -1.633005
O 6.426303 1.875922 0.500223
N 2.039522 -0.456682 0.324249
N 4.426275 0.975029 -0.337504
N -3.563493 -0.747818 0.130091
N -1.261748 -1.136560 0.474574
N 0.013275 -2.281950 -1.242391
N -2.369149 -1.845390 -1.583844
N -1.084405 -2.942829 -3.203903
C 2.872421 0.142332 1.397479
C 2.879519 -0.893136 -0.820121
C 3.639649 1.360918 0.850071
C 3.655106 0.302166 -1.403757
C 1.137542 -1.528202 0.825309
C -4.812655 -0.820118 -0.651844
C -5.322220 0.608130 -0.935042
C -3.647452 -0.100967 1.452028
C -5.418025 1.420811 0.350234
C -4.618068 1.077080 1.473362
C -0.109065 -1.655830 -0.032499
C -2.376244 -1.253260 -0.341431
C 5.764917 1.289772 -0.403774
C -6.303244 2.524569 0.446384
C -4.723994 1.837807 2.664472
C -6.399172 3.283260 1.631519
C -5.603687 2.936470 2.749562
C -1.157518 -2.336128 -1.976043
C 7.789832 1.135854 -1.769524
C 8.611549 0.004124 -1.144614
H 3.607116 -0.592092 1.816959
H 2.210959 0.474029 2.218659
H 2.222332 -1.330724 -1.590063
H 3.608475 -1.683185 -0.501904
H 4.331201 1.768402 1.604830
H 2.911073 2.146263 0.564950
H 2.932518 1.022657 -1.837985
H 4.347252 -0.027783 -2.191478
H 1.652028 -2.518279 0.870511
H 0.804854 -1.257849 1.840836
H -4.596703 -1.369803 -1.579356
H -5.569217 -1.381939 -0.067105
H -4.626696 1.098101 -1.645030
H -6.310015 0.561471 -1.431535
H -3.960508 -0.848411 2.213862
H -2.627546 0.216242 1.727158
H -6.924158 2.786038 -0.419799
H -4.106047 1.567810 3.530548
H -7.088539 4.133058 1.686964
H -5.669796 3.517087 3.676253
H 8.023605 2.104507 -1.293939
H 7.939514 1.201244 -2.859908
H -0.193799 -3.325945 -3.509707
H -1.921271 -3.015365 -3.776372
H 8.334276 -0.971891 -1.580029
H 8.452358 -0.029818 -0.053808
H 9.688654 0.173552 -1.332270


