%chk=000185098.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185098

0 1
O -0.939030 -2.117161 1.182302
O 0.706363 -3.435812 -0.241261
O -4.639236 0.164139 -0.350109
O -3.512227 -1.530488 0.365587
N -3.595307 -0.367478 -0.018206
C -0.895770 -1.634027 -0.169964
C 0.481766 -2.107596 -0.701906
C 0.046504 0.728525 -0.112489
C -1.088270 -0.129071 -0.132437
C 1.396779 0.187074 -0.138826
C 1.631955 -1.199929 -0.335473
C -0.129246 2.131090 -0.011799
C 2.502312 1.049962 0.043721
C -2.361346 0.440756 -0.068773
C 2.917597 -1.710460 -0.266634
C 1.025509 2.993474 0.105950
C 2.279503 2.475584 0.154358
C -1.440574 2.678277 0.000620
C 3.813600 0.509416 0.103436
C -2.538469 1.850340 -0.030921
C 4.013647 -0.851123 -0.032564
H -1.703225 -2.137409 -0.759798
H 0.446643 -2.229268 -1.815446
H 3.081548 -2.784159 -0.396962
H 0.854633 4.068438 0.170666
H 3.152709 3.120482 0.270087
H -1.566902 3.761134 0.045100
H 4.658530 1.179290 0.259791
H -3.556487 2.256994 -0.021080
H 5.016648 -1.273328 0.028188
H -1.890120 -2.243897 1.450949
H 0.530364 -3.486771 0.739795


%chk=000185098-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000185098

0 1
O -0.886935 -2.177078 1.252072
O 0.694361 -3.511430 -0.412110
O -4.693759 0.125764 -0.436430
O -3.537955 -1.531940 0.609201
N -3.594470 -0.367005 0.023525
C -0.876916 -1.658996 -0.134959
C 0.476329 -2.102207 -0.729080
C 0.054358 0.726304 -0.121150
C -1.082582 -0.147078 -0.128609
C 1.408814 0.183750 -0.131225
C 1.640306 -1.212540 -0.313140
C -0.130746 2.154209 -0.034044
C 2.529689 1.066709 0.058902
C -2.367406 0.445907 -0.075631
C 2.943445 -1.725762 -0.231433
C 1.019665 3.015580 0.088970
C 2.298126 2.488891 0.158748
C -1.453824 2.694700 -0.042242
C 3.847288 0.521031 0.127647
C -2.565198 1.857137 -0.074700
C 4.048238 -0.860275 0.005059
H -1.678290 -2.159424 -0.708840
H 0.393042 -2.059381 -1.833232
H 3.086407 -2.802926 -0.361410
H 0.858142 4.097527 0.149724
H 3.163431 3.150553 0.283087
H -1.586431 3.781017 0.000710
H 4.696897 1.197202 0.277385
H -3.585781 2.246907 -0.073628
H 5.059009 -1.276836 0.070723
H -1.844076 -2.182902 1.526721
H 0.367223 -3.620409 0.525292


