%chk=000249685.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249685

0 1
O -0.605765 0.703926 2.147058
O 3.046565 0.226707 -2.636468
O 4.995760 -0.304524 -1.878959
N -1.129130 -0.366980 0.164477
N 3.794225 -0.143703 -1.742692
C -2.543103 -0.111099 0.104448
C -3.256829 -0.495756 -1.062361
C 1.179123 -0.306304 0.930333
C -5.313514 0.350533 -0.051162
C -4.633105 -0.259433 -1.117939
C -3.221521 0.499933 1.170023
C 3.905820 -0.996234 0.636223
C -0.254249 0.081766 1.162609
C 3.183160 -0.414160 -0.429022
C 1.825197 -0.062610 -0.274632
C -4.595652 0.728605 1.090101
C 1.891336 -0.875801 2.006172
C 3.228020 -1.218857 1.853485
C -2.576233 -1.139906 -2.228477
C -6.784923 0.590552 -0.148518
C 5.335116 -1.372311 0.512304
H -5.190577 -0.550979 -2.007066
H -0.749939 -0.927354 -0.601328
H -2.676153 0.806581 2.070685
H 1.300693 0.410977 -1.116110
H -5.104774 1.205903 1.925934
H 1.380223 -1.035090 2.962084
H 3.770769 -1.660999 2.691198
H -1.798753 -0.489505 -2.654676
H -2.119049 -2.100995 -1.955856
H -3.277133 -1.355119 -3.048588
H -7.332192 -0.344315 -0.334782
H -7.203711 1.031061 0.765677
H -7.021189 1.277811 -0.973778
H 5.509654 -2.059087 -0.336525
H 5.965320 -0.490428 0.284938
H 5.746811 -1.847707 1.411491


%chk=000249685-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249685

0 1
O -0.663530 0.163064 2.463931
O 2.715223 -0.501794 -2.811991
O 4.848233 -0.851842 -2.112853
N -1.157858 -0.295616 0.209821
N 3.590867 -0.683048 -1.875822
C -2.566226 -0.071104 0.156072
C -3.218582 -0.295113 -1.098960
C 1.163537 -0.432036 0.996377
C -5.381176 0.350948 -0.065819
C -4.610640 -0.078820 -1.177711
C -3.315296 0.356874 1.281121
C 3.991151 -0.943894 0.631142
C -0.294464 -0.156141 1.289934
C 3.111747 -0.698032 -0.466239
C 1.730434 -0.444839 -0.293475
C -4.705380 0.562857 1.159182
C 2.017784 -0.657273 2.107530
C 3.386603 -0.910074 1.918624
C -2.441519 -0.751869 -2.324175
C -6.877321 0.575497 -0.197377
C 5.475307 -1.226167 0.530903
H -5.112072 -0.250691 -2.138998
H -0.745125 -0.632011 -0.661444
H -2.803531 0.518267 2.231035
H 1.156861 -0.232452 -1.200964
H -5.270934 0.893599 2.038272
H 1.577153 -0.618871 3.108790
H 4.023701 -1.089061 2.791266
H -1.663117 -0.021853 -2.626116
H -1.945674 -1.731767 -2.169425
H -3.115930 -0.871532 -3.187649
H -7.392584 -0.333386 -0.561148
H -7.328629 0.853207 0.770406
H -7.102092 1.385730 -0.917006
H 5.683634 -2.103014 -0.106113
H 6.018339 -0.386947 0.062791
H 5.891403 -1.405696 1.536386


