%chk=000256583.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256583

0 1
O 2.771034 1.384659 0.405814
O -0.006956 0.485180 -2.052728
O 0.312624 -0.729840 2.407411
O -2.098787 -1.640682 -1.190641
N -0.196261 -0.126091 0.203968
C 1.929322 -0.404465 -0.840395
C 2.040194 -0.818806 0.665346
C 2.953227 0.777856 -0.924167
C 3.112261 0.190758 1.198523
C 0.487367 0.050694 -1.044737
C 0.659119 -0.579081 1.266549
C 4.344230 0.154565 -0.751597
C 4.440802 -0.203359 0.540770
C -1.606264 0.109920 0.377426
C -2.558386 -0.613475 -0.379226
C -2.048609 1.055925 1.315123
C -3.928040 -0.359239 -0.232701
C -3.416248 1.294308 1.467832
C -4.350033 0.595275 0.694311
C -2.379442 -1.462493 -2.605626
H 2.174247 -1.223216 -1.544091
H 2.344085 -1.872936 0.814438
H 2.788431 1.541183 -1.686012
H 3.085127 0.450095 2.257883
H 5.044124 0.062539 -1.557548
H 5.241096 -0.668379 1.080509
H -1.321985 1.598253 1.922792
H -4.647681 -0.921462 -0.823693
H -3.755405 2.030687 2.195224
H -5.414626 0.791803 0.820000
H -1.843768 -0.573887 -2.967248
H -3.453927 -1.389598 -2.783016
H -1.965973 -2.380489 -3.037492


%chk=000256583-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000256583

0 1
O 2.757121 1.375676 0.707531
O 0.164323 0.874046 -2.040807
O 0.266518 -1.114264 2.220080
O -1.943378 -1.346691 -1.494577
N -0.120981 -0.095219 0.109068
C 2.057351 -0.240379 -0.871101
C 2.093391 -0.887422 0.545750
C 3.067229 0.967959 -0.699994
C 3.119010 0.051252 1.304849
C 0.619278 0.250449 -1.058782
C 0.672422 -0.742874 1.096094
C 4.464425 0.352338 -0.553550
C 4.495774 -0.215000 0.684035
C -1.517257 0.200781 0.274390
C -2.465773 -0.428920 -0.580752
C -1.944912 1.092799 1.275484
C -3.839789 -0.117769 -0.442842
C -3.318121 1.386230 1.427206
C -4.256573 0.786222 0.559950
C -2.863938 -1.931492 -2.473066
H 2.339937 -0.903778 -1.702863
H 2.398435 -1.944571 0.578224
H 2.920438 1.811341 -1.384404
H 3.019352 0.081383 2.395984
H 5.227140 0.335657 -1.333541
H 5.290005 -0.801751 1.148041
H -1.196416 1.554377 1.926773
H -4.583895 -0.578737 -1.098654
H -3.646687 2.080477 2.206468
H -5.322681 1.016924 0.662113
H -3.340402 -1.145975 -3.089481
H -3.640652 -2.544425 -1.976288
H -2.235796 -2.572441 -3.108338


