%chk=000298431.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298431

0 1
O 1.024426 -1.237449 -1.839549
N -0.691677 -0.650425 0.362217
N 0.875194 -2.105543 -0.951933
C -1.118509 0.041149 -0.898425
C -0.027358 0.262414 1.347869
C 0.034943 -1.876731 0.163365
C -2.216328 1.033219 -0.602424
C 1.290655 0.850099 0.903981
C -0.134301 -2.895880 1.109481
C -3.317478 0.674188 0.189828
C 2.484226 0.144987 1.116849
C -2.151073 2.320253 -1.157156
C 1.327019 2.107202 0.284148
C 1.504731 -3.335057 -1.084414
C 0.521138 -4.122309 0.977090
C -4.339204 1.596327 0.428075
C 3.703135 0.694048 0.709937
C -3.178561 3.237598 -0.919430
C 2.548513 2.652628 -0.120930
C 1.346414 -4.335087 -0.126302
C -4.272507 2.879223 -0.125834
C 3.737662 1.947983 0.091125
H -1.503427 -0.727305 -1.611066
H -0.255649 0.524367 -1.422818
H 0.099366 -0.300803 2.300332
H -0.762723 1.072825 1.573464
H -0.803980 -2.714644 1.955168
H -3.366186 -0.325867 0.620766
H 2.463166 -0.832512 1.593939
H -1.304964 2.605650 -1.780252
H 0.402711 2.658747 0.115410
H 2.137256 -3.467476 -1.968646
H 0.381498 -4.900685 1.724717
H -5.190978 1.314281 1.044380
H 4.627438 0.142516 0.871842
H -3.125795 4.233955 -1.354809
H 2.573034 3.627134 -0.605399
H 1.873519 -5.281643 -0.255675
H -5.070372 3.594990 0.058681
H 4.687222 2.372330 -0.228001


%chk=000298431-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298431

0 1
O 0.556777 -2.369184 -2.120943
N 0.347336 -0.560529 -0.034350
N 0.108767 -2.789343 -0.922482
C -0.208486 0.199766 -1.203017
C 0.733778 0.254232 1.140017
C -0.014958 -1.890257 0.171762
C -1.603659 0.747947 -0.922533
C 1.803844 1.293006 0.806598
C -0.440377 -2.417939 1.419144
C -2.741080 -0.098067 -1.007759
C 2.899557 0.963109 -0.030663
C -1.793037 2.106170 -0.557951
C 1.742494 2.583899 1.384720
C -0.224784 -4.127753 -0.757513
C -0.726983 -3.785036 1.592611
C -4.033203 0.399092 -0.728824
C 3.918540 1.908406 -0.278209
C -3.085579 2.608982 -0.282706
C 2.765724 3.529851 1.143603
C -0.622300 -4.649926 0.476670
C -4.209718 1.755342 -0.364540
C 3.857539 3.194008 0.311021
H -0.196594 -0.494908 -2.060548
H 0.494254 1.021697 -1.418394
H 1.143317 -0.435197 1.902270
H -0.145801 0.763306 1.591433
H -0.582408 -1.723553 2.250889
H -2.612257 -1.145782 -1.306713
H 2.933998 -0.029882 -0.494414
H -0.922980 2.773382 -0.503053
H 0.892909 2.850216 2.026656
H -0.106757 -4.716901 -1.668248
H -1.052920 -4.159967 2.566909
H -4.902402 -0.264244 -0.805077
H 4.759130 1.644179 -0.929738
H -3.216368 3.662665 -0.010425
H 2.707621 4.525374 1.598096
H -0.847262 -5.717116 0.551091
H -5.212942 2.143146 -0.154264
H 4.649464 3.926508 0.118476


