%chk=000201728.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201728

0 1
O 3.760819 -0.190668 -1.025755
C -2.711255 -0.034451 0.015115
C -2.919644 -1.585091 0.098248
C -1.192450 0.144449 -0.035250
C -1.525719 -2.244380 0.105570
C -0.544088 -1.109407 0.026311
C -0.454205 1.325822 -0.128421
C -3.294708 0.640806 1.264560
C -3.369550 0.517872 -1.256515
C 0.845939 -1.211555 0.012149
C 0.962689 1.236103 -0.141757
C 1.589291 -0.014390 -0.051775
C -1.119119 2.663805 -0.200681
C 1.536095 -2.535471 0.067453
C 1.808489 2.467510 -0.244432
C 3.086434 -0.093085 -0.025774
C 3.697770 -0.044784 1.348120
H -3.517511 -1.948683 -0.752640
H -3.485866 -1.860194 1.002026
H -1.404496 -2.935004 -0.749241
H -1.368228 -2.844163 1.020119
H -4.364453 0.432895 1.367826
H -2.794615 0.287235 2.173737
H -3.175630 1.728260 1.233541
H -2.953109 0.047677 -2.155069
H -4.450293 0.349294 -1.256765
H -3.200922 1.601424 -1.352551
H -0.525604 3.390092 -0.776816
H -2.108428 2.605658 -0.686801
H -1.263556 3.082249 0.804807
H 2.431178 -2.559151 -0.574053
H 1.852327 -2.776419 1.091393
H 0.893054 -3.357036 -0.275378
H 1.270270 3.303786 -0.717846
H 2.130284 2.811031 0.747540
H 2.709835 2.302050 -0.854365
H 3.436463 0.885913 1.868207
H 4.793283 -0.110370 1.303306
H 3.335730 -0.870029 1.974956


%chk=000201728-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201728

0 1
O 3.806211 -0.589552 -0.988528
C -2.733102 -0.022374 0.071700
C -2.873670 -1.543968 0.438646
C -1.194741 0.153435 0.032817
C -1.582138 -2.238672 -0.065485
C -0.559099 -1.113677 -0.032399
C -0.421168 1.342866 -0.008010
C -3.472056 0.825277 1.139800
C -3.339798 0.240237 -1.339456
C 0.844639 -1.254777 -0.093531
C 1.004893 1.226267 -0.025353
C 1.622921 -0.059399 -0.045646
C -1.049930 2.728938 -0.039630
C 1.456851 -2.645274 -0.162387
C 1.854581 2.489922 -0.089511
C 3.134687 -0.170975 -0.004612
C 3.811200 0.143287 1.329220
H -3.797010 -1.980460 0.016659
H -2.929775 -1.640145 1.540153
H -1.703076 -2.619242 -1.101073
H -1.296198 -3.106882 0.556186
H -4.506659 0.449627 1.258586
H -2.968608 0.749040 2.121094
H -3.539321 1.893453 0.871977
H -2.899166 -0.438238 -2.092830
H -4.434046 0.076047 -1.323509
H -3.156420 1.276423 -1.677055
H -0.498805 3.406113 -0.715888
H -2.093482 2.699136 -0.384131
H -1.043621 3.203392 0.961960
H 2.543602 -2.623256 -0.332350
H 1.259592 -3.213597 0.767966
H 1.007745 -3.225341 -0.989886
H 1.648115 3.057422 -1.017524
H 1.643701 3.173144 0.755054
H 2.934360 2.272646 -0.092072
H 3.349652 1.005152 1.839678
H 4.892026 0.305954 1.186872
H 3.673614 -0.732346 1.995598


