%chk=000257615.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257615

0 1
O -1.441826 0.070557 -1.410395
O -2.872813 1.990605 0.820375
O -1.601960 -1.272196 1.563755
O -4.527862 -1.633823 -0.642351
O 0.750776 2.948988 -1.531216
O 2.225431 -1.810928 2.263521
N 0.438859 1.022488 -0.336076
N 4.036890 -1.923539 0.912530
C -1.844709 1.021482 0.768600
C -2.415258 -0.422950 0.750636
C -1.031313 1.144640 -0.550933
C -2.192287 -0.943911 -0.685141
C -3.498649 -1.109080 -1.482585
C 0.969293 -0.055371 0.351045
C 1.304197 2.043247 -0.942248
C 2.334812 -0.200008 0.502159
C 2.725269 1.843413 -0.735396
C 3.220622 0.781724 -0.047311
C 2.821876 -1.352467 1.300889
H -1.247016 1.240506 1.683431
H -3.477809 -0.468560 1.078484
H -1.239719 2.084063 -1.133753
H -1.560524 -1.859686 -0.690360
H -3.354635 -1.748867 -2.370432
H -3.900746 -0.129617 -1.810397
H -3.500108 1.897993 0.065640
H -1.823926 -1.172638 2.516489
H 0.268304 -0.797345 0.790712
H 3.365769 2.612545 -1.170385
H -4.369724 -2.584226 -0.454058
H 4.296820 0.669483 0.108636
H 4.374210 -2.737438 1.405556
H 4.487455 -1.713686 0.041677


%chk=000257615-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257615

0 1
O -1.696113 0.460428 -1.418103
O -2.940341 2.069605 0.958617
O -1.632405 -1.360459 1.510351
O -4.239181 -2.214203 -0.761895
O 0.772657 2.939891 -1.705239
O 1.954519 -1.986603 2.148818
N 0.429979 1.045370 -0.319655
N 4.036285 -1.887681 1.136844
C -1.854168 1.089439 0.878144
C -2.415565 -0.368405 0.761417
C -1.030961 1.311444 -0.416232
C -2.252634 -0.741060 -0.733110
C -3.559155 -1.112717 -1.452370
C 0.939032 -0.010822 0.404597
C 1.283907 1.967146 -1.071656
C 2.305314 -0.277614 0.459547
C 2.703542 1.660941 -0.995504
C 3.194394 0.590699 -0.267862
C 2.734647 -1.435875 1.308957
H -1.271257 1.244868 1.799344
H -3.472922 -0.379688 1.085367
H -1.105152 2.342778 -0.796840
H -1.522980 -1.574322 -0.797115
H -3.349442 -1.356170 -2.512912
H -4.270545 -0.270976 -1.421284
H -3.439646 2.074980 0.100544
H -1.815986 -1.294985 2.480504
H 0.236104 -0.653356 0.952663
H 3.362752 2.340943 -1.541147
H -3.645621 -3.007474 -0.741887
H 4.279672 0.437306 -0.228698
H 4.343584 -2.667058 1.717201
H 4.657383 -1.540973 0.409692


