%chk=000245396.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245396

0 1
O -1.649881 0.411511 0.491052
O 2.323099 1.321172 -0.830724
O -0.445695 0.786713 -1.383991
C 2.024733 0.321222 0.150926
C 1.968182 -1.078485 -0.491620
C 3.146734 0.457863 1.197877
C 3.340907 -1.501296 -1.027863
C 4.497035 0.000118 0.631438
C 4.415755 -1.422759 0.064327
C 0.652929 0.684661 0.797393
C -2.906172 0.353720 -0.282978
C -3.979112 0.838653 0.701609
C -3.191957 -1.114031 -0.627809
C -4.976056 -0.319871 0.879900
C -4.645215 -1.369974 -0.198666
C -0.478844 0.639684 -0.179299
H 1.229901 -1.086509 -1.318060
H 1.610154 -1.815145 0.250908
H 2.892646 -0.129630 2.098424
H 3.223287 1.517555 1.512701
H 3.621795 -0.838024 -1.872001
H 3.284804 -2.525471 -1.439128
H 5.273100 0.058875 1.415521
H 4.804633 0.703171 -0.171443
H 4.191826 -2.143785 0.872404
H 5.397014 -1.720349 -0.349808
H 0.717331 1.717533 1.210226
H 0.443270 0.034279 1.670751
H -2.787041 1.001180 -1.173882
H -4.477104 1.746906 0.323484
H -3.512954 1.118738 1.666305
H -2.495253 -1.772595 -0.075055
H -3.032220 -1.321947 -1.698282
H -6.017772 0.029092 0.792259
H -4.877748 -0.759357 1.888412
H -4.778226 -2.395306 0.183080
H -5.327271 -1.267884 -1.061390
H 1.665286 1.295972 -1.570100


%chk=000245396-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245396

0 1
O -1.664606 0.623470 0.606661
O 2.309908 1.133960 -1.077550
O -0.480999 1.066588 -1.346606
C 1.998643 0.352846 0.137384
C 1.820702 -1.150654 -0.217818
C 3.209917 0.549581 1.078322
C 3.115178 -1.750773 -0.812852
C 4.502224 -0.057306 0.486325
C 4.314034 -1.554469 0.144761
C 0.716367 0.936032 0.809682
C -2.948062 0.587476 -0.194046
C -4.114533 0.694467 0.814480
C -3.101253 -0.785479 -0.912703
C -4.654021 -0.751320 0.971085
C -4.475756 -1.344506 -0.451257
C -0.500554 0.887050 -0.095604
H 0.983766 -1.266456 -0.934559
H 1.545606 -1.705691 0.703511
H 2.984505 0.071817 2.053946
H 3.343805 1.633603 1.256339
H 3.331152 -1.243498 -1.772623
H 2.963983 -2.825896 -1.030812
H 5.337658 0.075011 1.200911
H 4.760356 0.498438 -0.434433
H 4.137824 -2.128780 1.079245
H 5.237261 -1.960064 -0.312389
H 0.917498 2.000470 1.044646
H 0.485421 0.419684 1.756702
H -2.894775 1.430520 -0.903324
H -4.901087 1.342644 0.383641
H -3.781819 1.154127 1.760211
H -2.290624 -1.452075 -0.563837
H -3.005417 -0.693269 -2.006774
H -5.699236 -0.779854 1.325406
H -4.034910 -1.312710 1.696844
H -4.506415 -2.448033 -0.468457
H -5.284100 -0.977482 -1.112849
H 1.468256 1.186731 -1.614711


