%chk=000273246.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273246

0 1
O -0.399788 -0.057505 0.049267
O 3.574502 2.637965 -0.270517
O 3.877147 -2.144335 -0.158466
O 0.590504 2.387540 -0.243000
O 1.836538 -3.502686 0.004332
N -7.347584 0.434884 0.041561
C 1.804276 -1.125599 -0.065627
C 3.762885 0.330823 -0.215641
C 0.977653 0.018476 -0.045058
C 3.213936 -0.966673 -0.152042
C 2.870939 1.444845 -0.212491
C 1.474061 1.333635 -0.132330
C 1.194227 -2.474100 0.004990
C 5.092542 0.909061 -0.288165
C -0.994392 -1.324568 0.090915
C -0.279980 -2.461700 0.076530
C 4.943553 2.260830 -0.318113
C -2.450738 -1.178880 0.151531
C 5.325337 -2.150661 -0.261578
C 0.730048 3.374577 0.818214
C -3.088803 -0.036197 -0.140510
C -4.552826 0.110312 -0.080297
C -5.406888 -0.851828 -0.640025
C -5.113392 1.240678 0.536496
C -6.794292 -0.649778 -0.559425
C -6.510680 1.360781 0.579560
H 6.014446 0.360338 -0.311086
H -0.749368 -3.445498 0.111932
H 5.585984 3.111757 -0.371907
H -2.984240 -2.085547 0.458134
H 5.769349 -1.666027 0.611759
H 5.641372 -1.697827 -1.205071
H 5.526362 -3.233348 -0.256939
H 0.522384 2.918095 1.788314
H -0.038774 4.105738 0.544999
H 1.730098 3.819132 0.785400
H -2.535029 0.867994 -0.434957
H -5.006100 -1.732668 -1.136256
H -4.480180 2.006892 0.978024
H -7.498563 -1.374622 -0.986025
H -6.992125 2.223493 1.056066


%chk=000273246-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000273246

0 1
O -0.414424 -0.095294 -0.050497
O 3.598441 2.625963 0.042804
O 3.992383 -2.177602 -0.297017
O 0.552019 2.350229 0.074695
O 1.766987 -3.641496 -0.390604
N -7.509834 0.457391 0.079381
C 1.821951 -1.184388 -0.186115
C 3.782803 0.306083 -0.105243
C 0.987854 -0.020751 -0.073817
C 3.248532 -1.011460 -0.194693
C 2.880991 1.412445 -0.005619
C 1.480421 1.309016 0.025382
C 1.157805 -2.526755 -0.287374
C 5.120752 0.903273 -0.107857
C -1.047868 -1.338431 -0.150502
C -0.311840 -2.495731 -0.262258
C 4.968788 2.264387 -0.020128
C -2.500210 -1.257973 -0.122234
C 5.456643 -2.145287 -0.320028
C 0.919797 3.565034 0.833779
C -3.198350 -0.081627 -0.029660
C -4.659858 0.058034 0.004525
C -5.569440 -1.039439 -0.030442
C -5.233499 1.359370 0.078738
C -6.955880 -0.794040 0.008189
C -6.636045 1.508405 0.113010
H 6.080064 0.400935 -0.169788
H -0.822232 -3.459392 -0.339348
H 5.666622 3.096140 0.007381
H -3.012941 -2.224683 -0.185258
H 5.866259 -1.715615 0.613103
H 5.834206 -1.593802 -1.201104
H 5.746168 -3.203159 -0.396448
H 1.220181 3.304114 1.865601
H 0.000708 4.169328 0.848935
H 1.734990 4.115479 0.336556
H -2.617384 0.848617 0.021586
H -5.211464 -2.072478 -0.085142
H -4.588388 2.244767 0.107805
H -7.669674 -1.625233 -0.017287
H -7.091629 2.503422 0.169490


