%chk=000278846.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278846

0 1
O 6.973112 1.026720 0.000453
N -0.118809 1.358670 0.000144
N -0.258051 -1.522260 -0.000052
N 2.255818 1.242465 0.000267
N 2.115239 -1.632416 -0.000018
C -1.263163 0.714496 0.000046
C -1.335274 -0.772305 -0.000035
C 1.069802 0.591776 0.000158
C 0.994892 -0.870418 0.000029
C -2.522148 1.501827 0.000021
C -2.664642 -1.433497 -0.000073
C 3.388688 0.474003 0.000237
C 3.305598 -0.976022 0.000080
C 4.671930 1.100787 0.000365
C 4.528391 -1.750945 0.000029
C -3.111696 1.868659 1.217877
C -3.111522 1.868855 -1.217860
C -3.287496 -1.740909 -1.217842
C -3.287273 -1.741494 1.217660
C 5.802131 0.313298 0.000321
C 5.738627 -1.128363 0.000143
C -4.304011 2.597873 1.212015
C -4.303838 2.598066 -1.212052
C -4.545150 -2.350552 -1.212099
C -4.544930 -2.351132 1.211855
C -4.900842 2.960514 -0.000032
C -5.174487 -2.653603 -0.000137
C 8.228159 0.302496 0.000443
H 4.733117 2.191515 0.000494
H 4.433778 -2.841546 -0.000108
H -2.639988 1.594437 2.160115
H -2.639677 1.594788 -2.160074
H -2.791597 -1.513185 -2.159960
H -2.791197 -1.514231 2.159798
H 6.660994 -1.706102 0.000097
H -4.766427 2.886642 2.154841
H -4.766119 2.886987 -2.154898
H -5.033729 -2.592320 -2.154916
H -5.033336 -2.593353 2.154645
H -5.829671 3.528863 -0.000053
H -6.154337 -3.128455 -0.000162
H 8.323519 -0.298152 -0.908307
H 8.323410 -0.298369 0.909061
H 8.954501 1.128190 0.000584


%chk=000278846-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000278846

0 1
O 7.016233 1.054861 0.000415
N -0.117291 1.358991 -0.000173
N -0.253258 -1.527727 0.000048
N 2.234034 1.261398 0.000027
N 2.097643 -1.649094 0.000114
C -1.289994 0.704681 -0.000218
C -1.361123 -0.767841 -0.000032
C 1.048098 0.590929 -0.000035
C 0.974618 -0.871747 0.000028
C -2.540134 1.533957 -0.000543
C -2.684807 -1.473232 0.000309
C 3.371587 0.485310 0.000136
C 3.293553 -0.983071 0.000166
C 4.647095 1.120371 0.000219
C 4.513596 -1.738271 0.000272
C -3.129782 1.938491 1.222214
C -3.127585 1.940742 -1.223611
C -3.312895 -1.815949 -1.222333
C -3.310016 -1.819872 1.223322
C 5.813054 0.347720 0.000330
C 5.745637 -1.095720 0.000354
C -4.294728 2.736856 1.221337
C -4.292539 2.739096 -1.223364
C -4.552473 -2.492925 -1.221474
C -4.549607 -2.496827 1.223222
C -4.880721 3.137980 -0.001173
C -5.175761 -2.832951 0.001068
C 8.276191 0.300526 0.000553
H 4.700546 2.211430 0.000198
H 4.434687 -2.829259 0.000292
H -2.671401 1.639736 2.171851
H -2.667454 1.643785 -2.172965
H -2.827799 -1.563373 -2.172120
H -2.822634 -1.570394 2.172757
H 6.663662 -1.690710 0.000439
H -4.740210 3.048143 2.172650
H -4.736310 3.052134 -2.174903
H -5.027682 -2.756715 -2.172753
H -5.022581 -2.763654 2.174768
H -5.783859 3.758371 -0.001415
H -6.137393 -3.358124 0.001357
H 8.369917 -0.327273 -0.905807
H 8.369742 -0.327230 0.906961
H 9.062440 1.068752 0.000610


