%chk=000230328.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230328

0 1
O -1.450653 0.440016 2.522126
O -1.098556 0.215718 -2.090041
O -1.476081 4.275785 -0.096639
O -3.038397 2.701531 -0.414238
O 4.603217 -2.111908 -0.588883
O 2.748462 -2.118226 -1.700287
N -1.159093 0.657084 0.214439
N 3.545438 -1.607419 -0.929828
C -0.713995 2.059546 0.234583
C 0.471240 2.328145 -0.712025
C -1.537030 -0.046748 1.427306
C -1.358288 -0.147657 -0.974407
C -1.989203 -1.394262 0.958993
C -1.885216 -1.453788 -0.460135
C 1.710933 1.615785 -0.255441
C -1.897449 2.964325 -0.141382
C -2.447121 -2.470561 1.687620
C -2.236140 -2.590622 -1.155175
C 2.046873 0.372951 -0.808604
C 2.536989 2.184140 0.728959
C -2.810105 -3.639681 0.975629
C -2.706890 -3.698379 -0.408677
C 3.200653 -0.283245 -0.360554
C 3.690049 1.520290 1.158553
C 4.032813 0.279337 0.617895
H -0.420101 2.315564 1.299618
H 0.646018 3.427983 -0.766657
H 0.203977 2.028699 -1.755056
H -2.529480 -2.430049 2.774789
H -2.154404 -2.642399 -2.242556
H 1.419425 -0.086567 -1.583422
H 2.278285 3.151915 1.162860
H -3.175183 -4.504242 1.533485
H -2.989446 -4.609525 -0.940067
H 4.325612 1.972160 1.921635
H 4.931897 -0.252862 0.944825
H -2.203149 4.920864 -0.313240


%chk=000230328-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000230328

0 1
O -1.189083 0.489490 2.529846
O -1.386278 0.350359 -2.173092
O -1.575516 4.349969 -0.420697
O -3.145462 2.635214 -0.424068
O 4.508291 -2.281193 -0.570128
O 2.763021 -2.015056 -2.012501
N -1.166862 0.742108 0.166436
N 3.492276 -1.624034 -1.021367
C -0.771590 2.147903 0.148139
C 0.504604 2.422328 -0.713470
C -1.375897 0.016388 1.382658
C -1.478884 -0.043635 -0.984559
C -1.831321 -1.343008 0.962666
C -1.893523 -1.378919 -0.452369
C 1.695900 1.616889 -0.222934
C -1.970576 3.016044 -0.272730
C -2.163144 -2.463006 1.739289
C -2.285736 -2.537384 -1.138386
C 2.045366 0.399000 -0.850292
C 2.465454 2.058051 0.886542
C -2.564510 -3.639452 1.054511
C -2.623934 -3.676171 -0.361933
C 3.139526 -0.342410 -0.356578
C 3.560515 1.303198 1.363850
C 3.911046 0.086200 0.744126
H -0.553173 2.408087 1.204934
H 0.706481 3.504763 -0.647568
H 0.275910 2.180347 -1.764620
H -2.111199 -2.423955 2.831689
H -2.324705 -2.555337 -2.231775
H 1.489983 0.024838 -1.715899
H 2.207474 3.004857 1.376619
H -2.831031 -4.534769 1.626048
H -2.934037 -4.599579 -0.862266
H 4.141692 1.663363 2.218632
H 4.751254 -0.522495 1.087554
H -2.366432 4.904707 -0.660304


