%chk=000294910.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294910

0 1
O 2.503852 -1.888253 -0.416185
O -1.346595 -0.472906 0.125177
O -2.103153 -0.735164 2.275985
O 1.830084 -2.583556 1.678631
O -2.259299 -3.094368 -0.588599
O -3.578801 1.348634 -0.144891
N 1.204793 -0.526226 0.797723
N -0.847569 3.573644 -0.348767
N -2.616289 -0.786966 -0.331078
C 0.389487 1.274960 2.302674
C 0.276927 -0.209145 1.886179
C 0.167728 2.220275 1.182293
C 1.196899 2.823127 0.367577
C 0.534238 3.667984 -0.586659
C 3.280237 -3.137108 -0.720214
C -1.056906 2.688181 0.722325
C -1.190247 -0.513036 1.530896
C 2.601663 2.735102 0.342209
C -4.435537 -2.054381 -1.101173
C -4.868105 -0.586909 -0.951601
C 1.840411 -1.772788 0.770859
C 1.247902 4.415717 -1.545342
C 4.394257 -3.264110 0.306539
C 3.785510 -2.784778 -2.115919
C 2.312168 -4.308143 -0.709677
C -2.983830 -2.144084 -0.654230
C -3.667512 0.181724 -0.419081
C 3.298123 3.469695 -0.601598
C 2.626466 4.302797 -1.535496
H -0.326540 1.474846 3.130815
H 1.400458 1.439025 2.740867
H 0.515127 -0.874353 2.776703
H -2.055977 2.443352 1.059035
H 1.217603 0.089475 -0.019114
H -1.569618 4.021957 -0.878108
H 3.117138 2.094928 1.055041
H -5.058612 -2.735809 -0.485984
H -4.535201 -2.415554 -2.144235
H -5.205568 -0.150514 -1.912604
H -5.723216 -0.475474 -0.253499
H 0.730449 5.050168 -2.256358
H 5.062654 -4.099446 0.075096
H 3.985558 -3.440198 1.316028
H 5.000566 -2.352820 0.363221
H 4.406465 -3.587063 -2.526610
H 2.952016 -2.609656 -2.808845
H 4.381573 -1.862999 -2.103886
H 1.435925 -4.117252 -1.342396
H 2.785709 -5.229903 -1.060730
H 1.926944 -4.500821 0.306139
H 4.384262 3.416985 -0.640537
H 3.222086 4.860809 -2.256796


%chk=000294910-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000294910

0 1
O 2.494765 -1.791578 -0.471426
O -1.443156 -0.707865 0.067330
O -2.172118 -0.623863 2.316011
O 1.592152 -2.587751 1.578695
O -2.361152 -3.409111 -0.425262
O -3.723412 1.098974 -0.150399
N 1.147057 -0.446738 0.748276
N -0.571675 3.645738 -0.704093
N -2.784262 -1.078013 -0.241124
C 0.270067 1.405585 2.182826
C 0.206331 -0.116782 1.802061
C 0.206415 2.350222 1.007147
C 1.339317 3.005389 0.367275
C 0.817802 3.816330 -0.704069
C 3.214388 -3.091453 -0.813961
C -0.938312 2.767579 0.321677
C -1.247705 -0.511955 1.505529
C 2.742166 2.994116 0.597284
C -4.636598 -2.417265 -0.803799
C -5.089660 -0.937488 -0.676300
C 1.733901 -1.701310 0.692822
C 1.647714 4.601510 -1.534297
C 4.268289 -3.391202 0.270992
C 3.871727 -2.741110 -2.159751
C 2.177371 -4.222288 -0.964922
C -3.139423 -2.440374 -0.476527
C -3.835254 -0.132764 -0.326553
C 3.574617 3.774639 -0.227678
C 3.034235 4.569642 -1.282332
H -0.542216 1.603425 2.905376
H 1.224469 1.549474 2.720488
H 0.469855 -0.715469 2.694406
H -1.979108 2.477437 0.460659
H 1.271643 0.198224 -0.034894
H -1.221899 4.079745 -1.355461
H 3.173839 2.385488 1.400082
H -5.158756 -3.089764 -0.103000
H -4.783004 -2.824722 -1.818700
H -5.525489 -0.535098 -1.606302
H -5.832460 -0.786381 0.125399
H 1.236992 5.214694 -2.344337
H 4.865078 -4.272210 -0.028878
H 3.786319 -3.602358 1.238439
H 4.954522 -2.533621 0.388747
H 4.445240 -3.608055 -2.533829
H 3.105545 -2.475425 -2.908304
H 4.559070 -1.885141 -2.045665
H 1.397540 -3.937402 -1.692939
H 2.681401 -5.134117 -1.334859
H 1.695301 -4.449065 -0.001398
H 4.657679 3.773880 -0.062053
H 3.709555 5.165248 -1.906613


