%chk=000206948.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206948

0 1
O -0.980686 0.758240 -1.288029
O -5.265750 -0.526057 0.569621
N -0.147024 -1.024417 -0.162118
C 1.935595 1.486003 -0.015419
C 4.135232 1.233505 -0.525355
C 2.149022 -0.059236 0.085489
C 3.641635 -0.241650 -0.363296
C 2.883405 1.881984 -1.183486
C 2.657545 2.135475 1.198481
C 4.161260 1.945506 0.856789
C 1.180496 -0.844615 -0.815248
C 4.464696 -1.080479 0.605337
C -0.284095 -2.181570 0.754621
C -1.182224 -0.144516 -0.482197
C -0.459472 -3.518093 0.010028
C -2.524688 -0.342655 0.195338
C -1.835872 -3.679459 -0.623675
C -3.415086 0.882017 -0.006396
C -4.865568 0.584978 0.300523
C -5.788024 1.770164 0.245160
H 0.884734 1.780872 -0.138273
H 5.073119 1.320610 -1.083143
H 2.022288 -0.389203 1.137795
H 3.680845 -0.727514 -1.365469
H 2.602702 1.447417 -2.149294
H 2.969884 2.964609 -1.330020
H 2.395809 3.199896 1.288487
H 2.384902 1.659589 2.149604
H 4.684446 1.350029 1.618140
H 4.683823 2.910730 0.790111
H 1.030619 -0.305832 -1.783469
H 1.600073 -1.842984 -1.063717
H 4.076068 -2.101617 0.677839
H 5.509894 -1.145030 0.281600
H 4.465329 -0.655085 1.616795
H 0.629213 -2.233357 1.393001
H -1.136083 -2.015957 1.451724
H -0.278809 -4.346128 0.725067
H 0.322205 -3.619342 -0.770100
H -3.028621 -1.244702 -0.225561
H -2.408142 -0.559015 1.277182
H -2.640671 -3.619936 0.118770
H -1.929659 -4.650852 -1.124207
H -2.022669 -2.908184 -1.381825
H -3.049294 1.732727 0.603648
H -3.315308 1.245570 -1.058566
H -5.707357 2.316809 -0.702766
H -6.838100 1.459206 0.356614
H -5.577437 2.484845 1.051268


%chk=000206948-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000206948

0 1
O -1.048601 0.782284 -1.352393
O -5.332043 -0.670549 0.041131
N -0.194338 -0.932988 -0.033633
C 1.981717 1.394220 0.333464
C 4.060157 1.311602 -0.606409
C 2.212738 -0.136865 0.115794
C 3.617273 -0.189541 -0.610585
C 2.701912 2.013077 -0.900780
C 2.912262 1.859587 1.493141
C 4.347626 1.796215 0.845905
C 1.115503 -0.829851 -0.727701
C 4.607700 -1.204816 -0.010955
C -0.326969 -1.998594 0.985871
C -1.212014 -0.060775 -0.406584
C -0.444673 -3.430593 0.398255
C -2.544782 -0.135562 0.358593
C -1.704693 -3.658466 -0.461484
C -3.517297 0.964755 -0.094470
C -4.983054 0.537216 -0.070464
C -6.012844 1.652980 -0.204261
H 0.923042 1.669561 0.461098
H 4.881183 1.520744 -1.314016
H 2.284706 -0.648538 1.098551
H 3.447904 -0.468163 -1.673777
H 2.251731 1.721248 -1.865812
H 2.760599 3.115533 -0.855171
H 2.662552 2.889963 1.806993
H 2.819103 1.209701 2.383370
H 5.033537 1.124578 1.391326
H 4.820583 2.795254 0.826892
H 0.940475 -0.264298 -1.658657
H 1.453148 -1.848314 -1.004139
H 4.218663 -2.237164 -0.100791
H 5.584106 -1.170962 -0.530341
H 4.790002 -1.014574 1.062930
H 0.559719 -1.954717 1.649013
H -1.207107 -1.794302 1.616813
H -0.438599 -4.137769 1.252038
H 0.460081 -3.659850 -0.198100
H -3.031789 -1.115631 0.190017
H -2.364215 -0.063067 1.447831
H -2.628859 -3.522165 0.130497
H -1.718904 -4.683790 -0.873006
H -1.740219 -2.954851 -1.313024
H -3.396621 1.897120 0.489783
H -3.253133 1.253285 -1.135633
H -5.691685 2.409960 -0.942211
H -6.993441 1.239028 -0.486383
H -6.117943 2.172141 0.768877


