%chk=000213914.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213914

0 1
O -0.000738 -2.239784 -0.000426
O -0.000746 2.239808 0.001905
O 7.228822 -1.082111 -0.000557
O -7.230382 -1.082142 -0.001291
O 7.228816 1.082168 0.000179
O -7.230386 1.082139 -0.000732
N 1.007932 0.000014 0.000826
N -1.009479 0.000010 0.000577
N 6.665659 0.000027 -0.000093
N -6.667236 -0.000001 -0.000864
C -0.000801 -1.058012 0.000143
C -0.000807 1.058036 0.001254
C 2.422649 0.000017 0.000576
C -2.424220 0.000008 0.000224
C 3.109296 -1.230904 0.000058
C -3.110851 -1.230919 -0.000257
C 3.109290 1.230941 0.000889
C -3.110855 1.230932 0.000369
C 4.499829 -1.224886 -0.000155
C -4.501393 -1.224909 -0.000611
C 4.499823 1.224929 0.000672
C -4.501398 1.224916 0.000012
C 5.190847 0.000023 0.000145
C -5.192405 0.000002 -0.000480
H 2.563945 -2.177667 -0.000169
H -2.565503 -2.177685 -0.000353
H 2.563935 2.177701 0.001317
H -2.565511 2.177700 0.000774
H 5.064822 -2.166442 -0.000550
H -5.066378 -2.166468 -0.000992
H 5.064812 2.166488 0.000906
H -5.066386 2.166473 0.000103


%chk=000213914-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213914

0 1
O -0.000779 -2.257954 -0.000693
O -0.000788 2.257979 0.000833
O 7.305509 -1.141552 -0.000033
O -7.307034 -1.141589 -0.000675
O 7.305505 1.141607 0.000748
O -7.307039 1.141584 0.000102
N 1.023636 0.000015 0.000151
N -1.025205 0.000011 -0.000015
N 6.700603 0.000026 0.000633
N -6.702158 -0.000001 -0.000270
C -0.000782 -1.027588 -0.000316
C -0.000786 1.027613 0.000388
C 2.428978 0.000017 0.000271
C -2.430546 0.000008 -0.000077
C 3.129643 -1.237123 -0.000085
C -3.131205 -1.237137 -0.000524
C 3.129637 1.237161 0.000751
C -3.131210 1.237149 0.000308
C 4.533545 -1.234406 0.000039
C -4.535108 -1.234425 -0.000586
C 4.533540 1.234450 0.000872
C -4.535113 1.234432 0.000243
C 5.220718 0.000023 0.000519
C -5.222285 0.000002 -0.000202
H 2.577744 -2.181358 -0.000455
H -2.579303 -2.181369 -0.000821
H 2.577735 2.181393 0.001024
H -2.579312 2.181383 0.000653
H 5.104530 -2.166284 -0.000226
H -5.106091 -2.166305 -0.000926
H 5.104521 2.166330 0.001236
H -5.106099 2.166310 0.000531


