%chk=000181679.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181679

0 1
O -0.954667 2.407065 0.522324
O 3.300896 0.142049 0.136742
O -3.173681 2.014750 0.363115
O 4.694876 -1.636660 0.489969
N -1.763706 -2.042992 -0.253217
C -0.378153 -1.727775 -0.178472
C -0.278511 -0.311445 0.054256
C -2.507877 -0.878896 -0.076637
C -1.623102 0.203153 0.114740
C 0.985050 0.280085 0.174224
C 0.754582 -2.546401 -0.291726
C -2.277376 -3.398400 -0.480537
C -3.981977 -0.849454 -0.097040
C 2.089218 -0.559293 0.052946
C -2.038364 1.571262 0.329051
C 2.002687 -1.951105 -0.175183
C -1.229134 3.828874 0.718554
C -1.490833 4.488822 -0.620371
C 4.536963 -0.451181 0.363142
C 5.540092 0.648333 0.406471
H 1.084061 1.352519 0.351019
H 0.660355 -3.615010 -0.465043
H -3.380290 -3.417722 -0.488371
H -1.922318 -3.790499 -1.452331
H -1.930416 -4.083697 0.315922
H -4.429073 -1.452457 0.706041
H -4.347180 0.194151 0.056524
H -4.400229 -1.183208 -1.057126
H 2.912728 -2.551621 -0.247602
H -2.079267 3.934331 1.416301
H -0.286665 4.158779 1.191157
H -1.538909 5.579166 -0.530142
H -0.707867 4.241888 -1.348672
H -2.446391 4.146398 -1.045944
H 6.326289 0.488646 -0.348533
H 6.033262 0.685278 1.391242
H 5.090926 1.638768 0.220706


%chk=000181679-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000181679

0 1
O -1.008990 2.452962 0.520870
O 3.346761 0.126028 0.261732
O -3.295674 2.008280 0.342680
O 4.871161 -1.654173 -0.000889
N -1.776412 -2.050130 -0.224531
C -0.407671 -1.728349 -0.132903
C -0.300934 -0.314506 0.089417
C -2.539285 -0.889580 -0.066581
C -1.662838 0.205118 0.131261
C 0.984354 0.259939 0.214345
C 0.719285 -2.566466 -0.231190
C -2.277725 -3.407690 -0.449662
C -4.038613 -0.911850 -0.113351
C 2.106589 -0.585185 0.114354
C -2.103955 1.585498 0.330591
C 1.999703 -1.988657 -0.106344
C -1.341806 3.896407 0.699117
C -1.452308 4.599603 -0.657542
C 4.629423 -0.442990 0.196362
C 5.673345 0.633167 0.411925
H 1.109517 1.329760 0.385833
H 0.624176 -3.643791 -0.401217
H -3.376574 -3.398933 -0.490329
H -1.894920 -3.810538 -1.405235
H -1.962419 -4.080577 0.368712
H -4.463542 -1.560934 0.676482
H -4.411432 0.112093 0.038078
H -4.413124 -1.280043 -1.088035
H 2.897864 -2.601417 -0.178749
H -2.285438 3.974406 1.266855
H -0.503132 4.285906 1.299263
H -1.607588 5.684497 -0.507549
H -0.530475 4.460169 -1.248655
H -2.307225 4.204220 -1.231127
H 6.399559 0.606453 -0.418459
H 6.230013 0.417661 1.341260
H 5.216329 1.630145 0.480710


