%chk=000210117.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210117

0 1
O -0.024449 2.676450 -0.549755
O -3.879751 -2.555725 -1.110034
O -3.929339 1.573445 1.616813
O -5.311683 -0.889867 0.852722
N 1.559615 1.835783 -2.048339
N 3.823291 0.758081 0.263622
N -0.380940 0.564951 -1.459807
C 3.767067 1.237930 -1.144425
C 3.668690 2.781350 -1.210558
C 2.538656 0.710613 -1.947217
C 2.329374 3.116991 -1.887165
C 0.357122 1.758555 -1.253104
C 4.435590 -0.510159 0.502145
C 2.622242 1.079846 1.081290
C 4.116497 -1.273067 1.648780
C 5.460102 -0.973954 -0.357569
C -1.622722 0.244107 -0.836729
C 4.811030 -2.451574 1.920577
C 6.140771 -2.154314 -0.068609
C 5.821978 -2.903822 1.067904
C -2.210116 1.057641 0.141049
C -2.220438 -0.971974 -1.218939
C -3.443677 -1.348874 -0.639655
C -3.423700 0.662447 0.718277
C -4.080683 -0.522489 0.314324
C -5.061099 -3.157064 -0.516430
C -4.525957 1.047279 2.833646
C -6.415936 -0.139803 0.262759
H 4.711666 0.909275 -1.657158
H 3.741516 3.235806 -0.203949
H 4.518242 3.195717 -1.779599
H 2.841417 0.447274 -2.984464
H 2.111133 -0.202159 -1.492211
H 2.477982 3.525790 -2.909632
H 1.747188 3.870298 -1.311377
H 1.811721 0.339059 0.989117
H 2.209487 2.065716 0.803239
H 2.918393 1.149304 2.142997
H -0.068805 -0.077141 -2.195428
H 3.339447 -0.952409 2.336785
H 5.736144 -0.399265 -1.240670
H 4.557211 -3.027434 2.810861
H 6.930906 -2.495091 -0.737540
H 6.354837 -3.823995 1.286635
H -1.751420 2.001819 0.456942
H -1.770733 -1.635162 -1.952226
H -5.008555 -4.180657 -0.904450
H -5.003670 -3.130168 0.577716
H -5.950743 -2.631091 -0.871963
H -5.026870 1.931949 3.241726
H -5.233710 0.236595 2.627059
H -3.718336 0.706912 3.488473
H -7.282579 -0.542894 0.794230
H -6.285387 0.929925 0.456010
H -6.471617 -0.336358 -0.810496


%chk=000210117-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000210117

0 1
O -0.456628 2.905911 0.024681
O -3.997237 -2.710195 -0.838830
O -5.132291 1.896633 0.584987
O -6.015381 -0.780372 0.002940
N 1.489634 1.819967 -0.631647
N 4.466779 0.671366 0.207561
N -0.530627 0.612362 -0.560481
C 3.774799 1.156821 -1.003367
C 3.644849 2.701832 -1.125820
C 2.287406 0.672986 -1.108943
C 2.263718 3.080329 -0.537577
C 0.123329 1.842372 -0.362832
C 4.991227 -0.637216 0.219339
C 4.507210 1.457887 1.448286
C 5.743195 -1.110832 1.341198
C 4.797864 -1.543871 -0.873810
C -1.908384 0.320637 -0.366862
C 6.286378 -2.410843 1.353979
C 5.353816 -2.839301 -0.846649
C 6.104305 -3.290626 0.262328
C -2.857213 1.282481 0.064849
C -2.321295 -1.014955 -0.612079
C -3.674052 -1.389152 -0.473666
C -4.202484 0.895028 0.214685
C -4.643386 -0.425748 -0.079219
C -4.813289 -3.491099 0.116928
C -5.821958 1.657778 1.872802
C -6.839177 -0.177568 -1.074885
H 4.344120 0.776063 -1.869985
H 4.480154 3.236038 -0.644669
H 3.668626 2.958214 -2.199652
H 2.036360 0.411616 -2.161125
H 2.147233 -0.226319 -0.478881
H 1.760435 3.882936 -1.105118
H 2.314378 3.422253 0.514257
H 4.059632 0.898271 2.293806
H 3.936640 2.388487 1.331001
H 5.544456 1.730584 1.731259
H 0.033457 -0.176035 -0.881070
H 5.918407 -0.459874 2.201780
H 4.205812 -1.254776 -1.747050
H 6.861506 -2.736287 2.228867
H 5.186827 -3.504807 -1.701902
H 6.528826 -4.299459 0.278391
H -2.555608 2.308665 0.276590
H -1.609755 -1.787380 -0.925322
H -4.946212 -4.474176 -0.360410
H -4.269046 -3.608903 1.074102
H -5.786092 -3.003913 0.293311
H -6.520048 2.500835 1.990425
H -6.370720 0.699139 1.854810
H -5.088197 1.660177 2.701357
H -7.871043 -0.508893 -0.879625
H -6.773001 0.924438 -1.035004
H -6.501855 -0.545106 -2.061842


