%chk=000112114.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000112114

0 1
O 0.433814 0.237454 0.386062
O 4.533792 -1.512440 0.918748
O 4.800887 0.687464 0.578620
N 2.634730 -0.023005 -1.405467
C 2.644398 -0.403737 0.025059
C 1.749391 0.467067 0.935373
C -0.598185 1.048732 1.008952
C -1.873106 0.701883 0.288350
C -2.918010 1.637349 0.251845
C -2.029414 -0.548998 -0.323749
C 4.089004 -0.283417 0.504017
C -4.115101 1.314892 -0.392664
C -3.227166 -0.862318 -0.972087
C -4.271514 0.066959 -1.005539
H 2.307930 -1.479516 0.099592
H 1.773112 0.131981 1.986846
H 2.004599 1.539939 0.876643
H -0.328641 2.115134 0.900242
H -0.659404 0.782496 2.081683
H -2.802698 2.611737 0.721414
H -1.207769 -1.266965 -0.295222
H 2.843935 0.966892 -1.524139
H 1.705565 -0.185731 -1.795397
H -4.927752 2.039091 -0.419404
H -3.346098 -1.833224 -1.450681
H -5.204653 -0.179437 -1.508414
H 5.486055 -1.502981 1.210520


%chk=000112114-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000112114

0 1
O 0.475102 0.169593 0.207227
O 4.301006 -0.995533 1.712474
O 5.127764 0.305246 -0.026858
N 2.776821 -0.045078 -1.477076
C 2.773336 -0.453415 -0.077929
C 1.792511 0.361862 0.819028
C -0.571362 0.953755 0.869556
C -1.913728 0.657947 0.223525
C -2.995459 1.551908 0.425244
C -2.116317 -0.510065 -0.550084
C 4.181408 -0.327308 0.488707
C -4.264971 1.278507 -0.129959
C -3.385672 -0.779922 -1.111388
C -4.464329 0.109526 -0.901267
H 2.466093 -1.513678 0.020321
H 1.798616 -0.019404 1.861905
H 2.068259 1.440029 0.812182
H -0.336203 2.038978 0.796693
H -0.597031 0.689514 1.951950
H -2.846811 2.465947 1.014876
H -1.274794 -1.189631 -0.711806
H 3.504051 0.628976 -1.727825
H 1.846189 0.139740 -1.854933
H -5.093310 1.977334 0.032583
H -3.531612 -1.684512 -1.712744
H -5.447510 -0.102111 -1.336388
H 5.225653 -0.880904 2.063190


