%chk=000185679.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185679

0 1
O 2.035003 3.038462 -0.734842
O 3.546960 0.001359 -1.654374
O 5.774997 0.946627 -0.237568
O 2.955696 0.463324 1.954420
O -1.433156 2.010827 -1.298882
O -1.455689 -3.699501 1.418462
O 2.948803 -3.174898 0.264240
O -5.381066 3.388349 1.512018
O -6.221922 2.116162 -0.125537
N -0.017381 0.253457 -0.979777
N 1.488454 -1.565736 -0.438792
N -2.134360 -1.155571 0.264727
N 0.712487 -3.454753 0.837453
C 2.065292 1.604753 -0.658406
C 3.537892 1.293430 -1.013323
C 1.066292 1.005451 -1.669231
C 4.455752 1.273215 0.231248
C 0.220275 -0.998982 -0.404592
C -1.333007 0.877961 -0.883444
C -2.373036 0.020368 -0.253398
C -0.853838 -1.674908 0.221086
C 4.146276 0.140517 1.232012
C -3.776249 0.563409 -0.242853
C -0.665085 -2.978439 0.868219
C -3.871193 1.858701 0.568065
C 1.796131 -2.797123 0.245818
C -5.267171 2.399324 0.556273
H 1.825911 1.303928 0.395830
H 3.911336 2.031148 -1.765619
H 1.570003 0.350483 -2.422542
H 0.602550 1.833039 -2.271120
H 4.446584 2.267865 0.729188
H 3.905565 -0.819537 0.728790
H 4.999771 -0.024136 1.913952
H -4.476017 -0.201858 0.170761
H -4.118498 0.738280 -1.288742
H 1.124049 3.375421 -0.570114
H 2.299830 -1.080914 -0.908157
H 4.472942 -0.368023 -1.634130
H 6.244334 1.748878 -0.549404
H -3.532723 1.698949 1.616555
H -3.180122 2.633534 0.151269
H 0.908530 -4.353525 1.307581
H 3.154269 1.065922 2.702879
H -6.289373 3.791161 1.540996


%chk=000185679-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185679

0 1
O 1.822300 2.760024 -0.621519
O 3.631192 -0.451072 -0.655703
O 5.734055 0.832617 0.019227
O 3.241006 3.068443 1.741946
O -0.984634 2.018297 -0.961225
O -2.108749 -4.148351 0.407481
O 2.503115 -4.048474 -0.348181
O -4.947582 3.100086 2.366509
O -5.762687 2.625161 0.244065
N 0.041218 -0.077554 -1.080018
N 1.297715 -2.074548 -0.691828
N -2.302286 -1.299629 -0.201546
N 0.176329 -4.054151 -0.041573
C 2.065495 1.313692 -0.600074
C 3.551538 1.015041 -0.839707
C 1.214508 0.592495 -1.675500
C 4.549080 1.716990 0.119739
C 0.085855 -1.405332 -0.685560
C -1.100366 0.750173 -0.827972
C -2.314423 0.017605 -0.443736
C -1.125209 -2.013894 -0.280832
C 4.068391 1.878000 1.580829
C -3.601221 0.792342 -0.293464
C -1.121890 -3.454460 0.062698
C -3.603826 1.660107 0.988976
C 1.399381 -3.448362 -0.358581
C -4.874389 2.477884 1.110990
H 1.796758 0.907486 0.398235
H 3.834523 1.263102 -1.882543
H 1.806373 -0.159840 -2.218622
H 0.845335 1.336541 -2.401115
H 4.775584 2.726049 -0.278332
H 3.550150 0.955475 1.923292
H 4.945164 2.032924 2.237112
H -4.434178 0.071461 -0.263003
H -3.751786 1.455583 -1.164497
H 0.830095 2.883835 -0.715459
H 2.213017 -1.564285 -0.766658
H 4.583550 -0.658310 -0.442729
H 6.491975 1.200228 0.534327
H -3.497128 1.038769 1.896482
H -2.750927 2.365350 0.980310
H 0.222579 -5.052888 0.185478
H 2.622063 3.158636 0.954256
H -5.780966 3.643153 2.415021


