%chk=000206837.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206837

0 1
O -1.050649 2.460358 -0.816634
O -0.016880 -2.029063 0.233667
N 2.422370 0.115869 -0.806321
C 4.924786 -0.442840 0.594264
C 4.582541 0.968818 0.099619
C 3.650904 -1.255471 0.857599
C 3.648624 0.914660 -1.120106
C 2.727454 -1.270633 -0.369413
C 1.235408 0.755594 -0.718976
C -0.032128 0.315204 -0.394295
C -1.140266 1.298477 -0.485543
C -0.578777 -0.968311 0.041104
C -2.396712 0.575941 -0.084709
C -2.065466 -0.765837 0.228077
C -3.698354 1.030330 0.002155
C -3.034744 -1.664110 0.630407
C -4.691309 0.115088 0.413120
C -4.366242 -1.204205 0.720749
H 5.558318 -0.962621 -0.150300
H 5.530903 -0.381232 1.518433
H 4.105406 1.547283 0.915956
H 5.505923 1.518420 -0.164936
H 3.906628 -2.296773 1.133837
H 3.106359 -0.839816 1.729415
H 3.375307 1.940811 -1.448604
H 4.163026 0.429119 -1.981582
H 3.206305 -1.805536 -1.219484
H 1.782907 -1.833743 -0.136050
H 1.274545 1.837903 -1.012413
H -3.950977 2.062427 -0.239013
H -2.778871 -2.695804 0.870225
H -5.724817 0.451986 0.488490
H -5.146321 -1.896595 1.036163


%chk=000206837-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206837

0 1
O -1.078140 2.481346 -0.860092
O -0.081629 -2.109171 0.398398
N 2.442611 0.167333 -0.652414
C 5.066854 -0.474052 0.491849
C 4.693608 0.970703 0.083995
C 3.797896 -1.277592 0.859087
C 3.637045 0.964592 -1.044744
C 2.753974 -1.240272 -0.281104
C 1.216373 0.739331 -0.648660
C -0.071470 0.280658 -0.336096
C -1.177994 1.270862 -0.486566
C -0.649550 -0.997744 0.128398
C -2.447151 0.563205 -0.111538
C -2.133655 -0.770931 0.249473
C -3.770250 1.035069 -0.085406
C -3.136075 -1.671122 0.648012
C -4.788320 0.132487 0.314495
C -4.474788 -1.204109 0.676690
H 5.585666 -0.971760 -0.353524
H 5.776284 -0.460505 1.339876
H 4.286236 1.514821 0.958113
H 5.585998 1.524318 -0.264436
H 4.049847 -2.334098 1.067151
H 3.340878 -0.864455 1.779062
H 3.317364 1.990112 -1.295920
H 4.073193 0.507597 -1.957362
H 3.169797 -1.738530 -1.182205
H 1.821635 -1.754790 0.007034
H 1.217348 1.796432 -0.960980
H -3.996912 2.068330 -0.367262
H -2.879112 -2.698669 0.924438
H -5.831310 0.466936 0.345567
H -5.281052 -1.880635 0.981573


