%chk=000230494.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230494

0 1
O 2.290765 3.410605 0.165071
O 4.277627 2.463344 0.514299
N -5.539917 0.143703 0.235778
N 0.760218 -1.294917 -0.153963
C 0.169142 -0.107575 0.005535
C -1.305130 -0.056517 0.030908
C 2.975139 -0.209023 -0.035994
C 2.146680 -1.362844 -0.177563
C 2.307873 1.050093 0.136560
C -4.132793 0.028087 0.083400
C 0.934562 1.106069 0.161276
C -1.998803 1.015836 -0.555867
C -2.041122 -1.094707 0.630172
C -3.387551 1.062284 -0.536773
C -3.430328 -1.057784 0.661013
C 4.393064 -0.377837 -0.070507
C 2.745280 -2.654529 -0.355296
C 4.941693 -1.624100 -0.241271
C 4.110298 -2.774129 -0.386514
C -6.254474 1.029113 -0.723651
C -6.296901 -1.109981 0.500990
C 3.098829 2.298788 0.297804
H 0.410557 2.055288 0.306057
H -1.446225 1.819104 -1.045952
H -1.510867 -1.942640 1.072160
H -3.895489 1.907485 -0.995251
H -3.969627 -1.870227 1.142572
H 5.033696 0.503578 0.049256
H 2.084579 -3.516480 -0.463515
H 6.023366 -1.754897 -0.267175
H 4.582116 -3.747403 -0.521609
H -6.229769 0.664658 -1.762792
H -5.812094 2.040998 -0.695625
H -7.307496 1.133245 -0.413935
H -7.348797 -0.865502 0.722653
H -5.888469 -1.606485 1.399553
H -6.272538 -1.825724 -0.335908
H 2.801309 4.259124 0.275705


%chk=000230494-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000230494

0 1
O 2.292013 3.489187 -0.329288
O 4.383370 2.512921 -0.263872
N -5.583773 -0.039272 -0.014833
N 0.783782 -1.280496 0.050974
C 0.184603 -0.062783 -0.044456
C -1.296655 -0.023936 -0.041498
C 3.036779 -0.198628 -0.043129
C 2.163753 -1.358490 0.052870
C 2.371958 1.086317 -0.142907
C -4.187914 -0.033905 -0.024507
C 0.973195 1.136078 -0.142002
C -2.043793 1.181461 -0.158607
C -2.035953 -1.234811 0.082950
C -3.447549 1.185750 -0.151873
C -3.436148 -1.250061 0.092907
C 4.454036 -0.402869 -0.031499
C 2.741265 -2.666622 0.156029
C 4.984226 -1.693945 0.070738
C 4.126715 -2.833792 0.165181
C -6.326417 1.223109 -0.123532
C -6.315970 -1.307610 0.102235
C 3.136165 2.363995 -0.246089
H 0.491972 2.111675 -0.215528
H -1.534566 2.145761 -0.261040
H -1.470594 -2.167323 0.173030
H -3.970435 2.141173 -0.248500
H -3.951927 -2.209040 0.194424
H 5.113243 0.464532 -0.103560
H 2.051729 -3.513259 0.226160
H 6.071070 -1.832502 0.078306
H 4.560690 -3.836712 0.244508
H -6.122103 1.741180 -1.082815
H -6.073322 1.919768 0.701119
H -7.407232 1.018189 -0.073058
H -7.398743 -1.109418 0.069108
H -6.093233 -1.826173 1.056870
H -6.071143 -2.000636 -0.727714
H 2.865312 4.299286 -0.395502


