%chk=000265210.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000265210

0 1
O 0.787202 -0.245476 1.987530
O -0.787374 -0.246000 -1.987589
N 2.073427 0.463378 0.241378
N -2.073444 0.463239 -0.241487
C 0.768133 -1.694670 0.076241
C -0.768051 -1.694721 -0.075946
C 1.226141 -2.940708 0.856092
C -1.226009 -2.940932 -0.855556
C 1.203028 -0.440647 0.847206
C -1.203000 -0.440860 -0.847140
C 0.552851 -4.190645 0.376270
C -0.552660 -4.190744 -0.375497
C 2.577211 0.302408 -1.162402
C 2.488383 1.707902 0.979876
C -2.488538 1.707534 -0.980286
C -2.577233 0.302531 1.162326
C 4.110777 0.296679 -1.179025
C 1.997689 1.383569 -2.076280
C 3.277390 1.333902 2.239787
C 1.266413 2.567071 1.319439
C -1.266661 2.566760 -1.320051
C -3.277475 1.333117 -2.240113
C -1.997808 1.383930 2.075981
C -4.110798 0.296680 1.178937
H 1.218098 -1.723398 -0.955385
H -1.218002 -1.723274 0.955690
H 2.327101 -3.042099 0.783372
H 1.004716 -2.804516 1.941128
H -2.326964 -3.042361 -0.782813
H -1.004593 -2.804942 -1.940620
H 1.023381 -5.117158 0.702593
H -1.023151 -5.117342 -0.701635
H 2.217480 -0.701348 -1.545107
H 3.159190 2.292505 0.293868
H -3.159425 2.292226 -0.294430
H -2.217423 -0.701107 1.545270
H 4.517199 -0.436708 -0.472915
H 4.534144 1.272025 -0.912737
H 4.485932 0.042546 -2.176744
H 2.250886 2.397008 -1.754031
H 2.354750 1.261696 -3.104404
H 0.889738 1.309425 -2.113984
H 4.146557 0.712725 2.004357
H 2.647634 0.761565 2.940967
H 3.627065 2.225441 2.767630
H 0.674870 2.810147 0.422091
H 0.586258 2.028144 2.008980
H 1.558634 3.501293 1.804359
H -0.675167 2.810148 -0.422755
H -1.558981 3.500818 -1.805226
H -0.586424 2.027729 -2.009429
H -3.627244 2.224478 -2.768194
H -2.647635 0.760675 -2.941131
H -4.146573 0.711896 -2.004541
H -0.889854 1.309860 2.113726
H -2.354886 1.262251 3.104121
H -2.251066 2.397282 1.753509
H -4.517154 -0.436905 0.472995
H -4.485942 0.042748 2.176712
H -4.534244 1.271928 0.912418


%chk=000265210-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000265210

0 1
O 0.756117 0.241712 1.701031
O -0.756846 0.241044 -1.701747
N 2.452010 0.456823 0.118999
N -2.452113 0.456505 -0.119070
C 0.775536 -1.441841 -0.053784
C -0.775469 -1.441997 0.053572
C 1.364705 -2.701413 0.642824
C -1.364377 -2.701751 -0.642920
C 1.333003 -0.176718 0.634791
C -1.333214 -0.177041 -0.635090
C 0.612033 -3.970796 0.294388
C -0.611427 -3.970946 -0.294407
C 3.147873 0.012519 -1.132335
C 2.931411 1.736267 0.751229
C -2.931998 1.735657 -0.751533
C -3.147437 0.012429 1.132637
C 4.681750 -0.085139 -0.948221
C 2.748804 0.903075 -2.333862
C 3.508657 1.490403 2.165361
C 1.853799 2.846574 0.742764
C -1.854567 2.846151 -0.743944
C -3.509870 1.489220 -2.165314
C -2.747896 0.903264 2.333795
C -4.681383 -0.085325 0.949170
H 1.011826 -1.459318 -1.130052
H -1.011755 -1.459425 1.129843
H 2.432792 -2.815545 0.364722
H 1.353487 -2.546579 1.742227
H -2.432433 -2.816090 -0.364786
H -1.353219 -2.547009 -1.742337
H 1.100111 -4.924416 0.539402
H -1.099296 -4.924686 -0.539372
H 2.799536 -1.011020 -1.341177
H 3.758301 2.082347 0.104543
H -3.758643 2.081824 -0.104585
H -2.798956 -1.011049 1.341559
H 4.937492 -0.694087 -0.062580
H 5.160170 0.904860 -0.840735
H 5.123178 -0.567099 -1.839433
H 3.071297 1.949755 -2.180009
H 3.229532 0.535975 -3.259741
H 1.652963 0.885630 -2.469153
H 4.319892 0.740708 2.135863
H 2.716395 1.130113 2.840629
H 3.922055 2.432436 2.571638
H 1.454418 3.001389 -0.275282
H 1.019968 2.582667 1.411349
H 2.304908 3.795625 1.088449
H -1.454698 3.001346 0.273852
H -2.306009 3.795021 -1.089693
H -1.021032 2.582181 -1.412868
H -3.923585 2.431049 -2.571736
H -2.717858 1.128811 -2.840811
H -4.320988 0.739421 -2.135194
H -1.651985 0.885966 2.468545
H -3.228125 0.536280 3.259977
H -3.070576 1.949882 2.179916
H -4.937459 -0.694511 0.063789
H -5.122433 -0.567063 1.840689
H -5.159871 0.904633 0.841616


