%chk=000276864.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276864

0 1
O 0.459286 -0.051074 -0.002531
O -2.060260 -0.015903 -0.006194
O 2.048074 -3.235902 0.002761
O 4.168319 2.962902 0.000306
O -4.821703 2.146081 -0.012269
O -2.687798 2.538875 -0.009227
N -3.650927 1.797385 -0.010152
C 2.654964 -0.875180 0.001521
C 1.820552 0.278477 -0.000785
C 0.382562 -1.463474 -0.001357
C 1.799354 -2.061595 0.001311
C -0.806925 -2.076435 -0.002583
C 4.040659 -0.718732 0.003465
C 2.294126 1.573776 -0.001250
C -2.087048 -1.415712 -0.005120
C 3.702532 1.685563 0.000768
C 4.571656 0.572256 0.003090
C -3.394324 -1.881336 -0.006819
C -3.412552 0.364063 -0.008631
C -4.246516 -0.737917 -0.009062
H -0.841834 -3.178492 -0.001624
H 4.692609 -1.595744 0.005245
H 1.649343 2.451584 -0.003015
H 5.647569 0.717542 0.004577
H -3.717909 -2.906655 -0.006516
H -5.325644 -0.734382 -0.010768
H 5.162235 3.012229 0.001761


%chk=000276864-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000276864

0 1
O 0.571232 0.153891 -0.002692
O -2.295377 0.104716 -0.006755
O 1.921542 -3.197744 0.002330
O 4.575537 2.923451 0.001144
O -5.432986 1.835944 -0.013118
O -3.276769 2.643660 -0.010758
N -4.140822 1.683618 -0.010721
C 2.710076 -0.836181 0.001445
C 1.978775 0.379544 -0.000739
C 0.396629 -1.249713 -0.001707
C 1.740771 -1.944241 0.000853
C -0.822508 -1.872838 -0.002931
C 4.121146 -0.792998 0.003645
C 2.564220 1.642695 -0.000911
C -2.133547 -1.302032 -0.005311
C 3.983627 1.660391 0.001306
C 4.759519 0.461030 0.003568
C -3.404792 -1.910816 -0.006590
C -3.673521 0.326365 -0.008886
C -4.384241 -0.873086 -0.008856
H -0.769501 -2.968426 -0.001904
H 4.699998 -1.721602 0.005358
H 1.988703 2.570082 -0.002608
H 5.854601 0.522476 0.005233
H -3.588670 -2.983369 -0.005925
H -5.466757 -0.965918 -0.010303
H 5.563517 2.863303 0.002737


