%chk=000276842.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276842

0 1
O 7.606237 -3.060026 -0.244137
O -7.603044 -3.065144 0.247052
O -2.359261 4.996536 0.054071
O 2.357580 4.997790 -0.062568
O -3.399480 3.301455 0.891668
O 3.400392 3.300100 -0.891595
N -2.417273 3.826372 0.395573
N 2.416863 3.826363 -0.399551
C 1.216538 1.595998 -0.189453
C -1.216698 1.595891 0.187283
C 0.000013 0.922978 -0.000831
C -1.199320 3.016546 0.197798
C 1.198999 3.016626 -0.201139
C -0.000255 3.712108 -0.002021
C 2.453029 0.836629 -0.371510
C -2.453035 0.836508 0.369856
C 2.794108 -0.222249 0.383362
C -2.792775 -0.224660 -0.382483
C 4.040040 -0.975256 0.229145
C -4.038267 -0.978164 -0.227743
C 5.167578 -0.415588 -0.413681
C 4.123395 -2.281411 0.742135
C -5.164660 -0.420640 0.418979
C -4.122435 -2.282968 -0.744151
C 6.340739 -1.141859 -0.550663
C 5.290825 -3.035127 0.611578
C -6.337352 -1.147564 0.556387
C -5.289411 -3.037302 -0.613348
C 6.391203 -2.456198 -0.035934
C -6.388608 -2.460458 0.038052
C 7.791350 -4.409646 0.249807
C -7.788918 -4.413399 -0.250352
H 0.000179 -0.170301 -0.000354
H -0.000358 4.818732 -0.002608
H 3.113475 1.209397 -1.169876
H -3.114656 1.211063 1.166450
H 2.134560 -0.574516 1.185662
H -2.132069 -0.578556 -1.183149
H 5.117812 0.606936 -0.799260
H 3.263163 -2.722783 1.247555
H -5.114347 0.600787 0.807399
H -3.263150 -2.722758 -1.252574
H 7.219166 -0.724441 -1.040063
H 5.332573 -4.043447 1.008972
H -7.214849 -0.731730 1.048803
H -5.331757 -4.044509 -1.013504
H 8.827265 -4.616268 -0.051899
H 7.688991 -4.433501 1.338395
H 7.095955 -5.093959 -0.244117
H -7.688775 -4.434144 -1.339210
H -7.092395 -5.098979 0.240217
H -8.824182 -4.621065 0.052875


%chk=000276842-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000276842

0 1
O 7.329093 -3.400246 -0.221488
O -7.326229 -3.404320 0.221329
O -2.302968 5.456793 -0.056436
O 2.302962 5.456712 0.051980
O -3.501616 3.717152 0.782375
O 3.500813 3.714658 -0.783311
N -2.407687 4.216426 0.296218
N 2.407170 4.215603 -0.298228
C 1.256972 1.909560 -0.144565
C -1.257719 1.909503 0.144308
C -0.000337 1.263601 0.000013
C -1.213253 3.352908 0.155643
C 1.212380 3.352818 -0.156724
C -0.000440 4.043674 -0.000820
C 2.491154 1.124192 -0.247404
C -2.491501 1.123508 0.247044
C 2.622377 -0.191037 0.140714
C -2.621638 -0.191978 -0.140571
C 3.834384 -1.003343 0.039767
C -3.833100 -1.005093 -0.039703
C 5.059467 -0.526310 -0.528348
C 3.812226 -2.340195 0.530236
C -5.058727 -0.528657 0.527735
C -3.809819 -2.342155 -0.529551
C 6.190990 -1.345112 -0.598683
C 4.942264 -3.178205 0.466968
C -6.189703 -1.348220 0.598021
C -4.939294 -3.180926 -0.466327
C 6.141680 -2.677332 -0.101118
C -6.139273 -2.680633 0.101082
C 7.350605 -4.778642 0.282710
C -7.346589 -4.782959 -0.282248
H -0.000310 0.171235 0.000133
H -0.000456 5.135909 -0.001215
H 3.357763 1.658558 -0.638316
H -3.358543 1.657384 0.637556
H 1.765707 -0.704324 0.602086
H -1.764423 -0.704865 -0.601405
H 5.123647 0.495599 -0.915382
H 2.886818 -2.728634 0.973716
H -5.123769 0.493389 0.914264
H -2.883975 -2.730144 -0.972515
H 7.129826 -0.985478 -1.030089
H 4.882686 -4.198599 0.856264
H -7.128954 -0.989044 1.028905
H -4.878859 -4.201454 -0.855141
H 8.371329 -5.137030 0.087723
H 7.143612 -4.809158 1.369481
H 6.621286 -5.412764 -0.256702
H -7.139163 -4.813829 -1.368927
H -6.617031 -5.416326 0.257729
H -8.367136 -5.141971 -0.087484


