%chk=000225911.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225911

0 1
O -3.220049 1.334945 -0.000010
O -3.860888 -0.926990 0.044727
O -1.066883 1.954343 0.298382
O -2.361426 -2.591976 -0.272332
O 4.214826 2.520202 0.014640
O 2.061065 2.381951 -0.006452
N 0.839816 0.032774 0.051424
N 3.176774 1.879822 0.013593
C 2.167789 -0.462365 0.039013
C 3.283296 0.414195 0.032957
C 2.410539 -1.859478 0.039717
C -1.566196 -0.356250 -0.002171
C -0.262825 -0.795664 -0.028729
C 4.594752 -0.118741 0.037769
C 3.704708 -2.358810 0.040458
C 4.807725 -1.486839 0.041663
C -1.889270 1.067119 0.116234
C -2.591909 -1.407542 -0.095155
C -3.634092 2.741737 0.088632
C -4.959499 -1.898106 -0.013081
C -3.311479 3.458498 -1.204512
C -5.058870 -2.641941 1.301693
H 0.680204 1.089052 0.126031
H 1.569342 -2.558915 0.041672
H -0.082518 -1.891800 -0.124468
H 5.443469 0.580474 0.036833
H 3.869717 -3.439900 0.041404
H 5.821089 -1.888238 0.045070
H -4.718187 2.613225 0.262646
H -3.140984 3.198235 0.964957
H -5.811446 -1.218254 -0.198661
H -4.792443 -2.569975 -0.873212
H -3.757698 4.459231 -1.231599
H -2.223434 3.579474 -1.328610
H -3.677501 2.902400 -2.077019
H -5.969136 -3.250236 1.351589
H -4.200543 -3.316900 1.440407
H -5.068733 -1.950854 2.154702


%chk=000225911-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225911

0 1
O -3.233181 1.499729 -0.275584
O -3.945949 -1.027362 0.321475
O -1.024300 1.989340 0.259102
O -2.374110 -2.617767 -0.327241
O 4.163486 2.335356 1.281888
O 1.933602 2.298803 0.830205
N 0.778368 0.022406 0.084097
N 3.106308 1.733516 0.849188
C 2.100525 -0.449213 -0.018006
C 3.235377 0.353909 0.348080
C 2.376443 -1.763403 -0.504554
C -1.662152 -0.319643 -0.001973
C -0.339512 -0.763407 -0.008688
C 4.557168 -0.149125 0.249862
C 3.687360 -2.253899 -0.596422
C 4.791845 -1.449554 -0.215555
C -1.935829 1.132507 0.025895
C -2.666541 -1.420593 -0.040206
C -3.517655 2.971303 -0.286054
C -4.986286 -2.102973 0.335410
C -3.170866 3.583921 -1.645858
C -4.982428 -2.845733 1.674759
H 0.629127 1.039988 0.277706
H 1.554927 -2.400783 -0.840652
H -0.206715 -1.847307 -0.075957
H 5.374922 0.510939 0.549923
H 3.852159 -3.266119 -0.980232
H 5.813462 -1.832024 -0.292946
H -4.597470 3.017900 -0.073383
H -2.942952 3.447807 0.526906
H -5.924260 -1.548861 0.171899
H -4.794311 -2.792059 -0.505510
H -3.488209 4.643207 -1.665882
H -2.083920 3.547318 -1.826632
H -3.691387 3.052538 -2.461306
H -5.821756 -3.565450 1.703196
H -4.042364 -3.406338 1.807835
H -5.103824 -2.140971 2.515417


