%chk=000253918.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253918

0 1
O -0.980427 -0.617589 -3.244883
O 1.646512 0.381686 -2.829714
N -2.309648 -0.892844 0.049635
N 0.122422 -0.322778 -1.223357
C -2.601675 -1.940548 1.088622
C -3.324384 0.231634 0.056941
C -2.093741 -1.474532 -1.303171
C -1.348371 -2.799051 1.307732
C -3.821613 -2.819578 0.772873
C -3.078802 1.212526 -1.095286
C -3.207105 0.978248 1.395905
C -0.957784 -0.755150 -2.044645
C 1.350744 0.252661 -1.668541
C 2.226903 0.666042 -0.518888
C 2.788848 -0.297180 0.327766
C 2.505017 2.026054 -0.335340
C 3.629090 0.106513 1.369302
C 3.342315 2.423107 0.711475
C 3.902964 1.465000 1.562635
H -2.809166 -1.381623 2.045588
H -4.364397 -0.180922 -0.041082
H -1.806195 -2.551324 -1.235712
H -2.998281 -1.446815 -1.953391
H -1.490199 -3.487880 2.147593
H -1.096415 -3.403476 0.428819
H -0.476914 -2.173202 1.534285
H -4.717382 -2.216690 0.587234
H -4.048910 -3.489867 1.609308
H -3.665380 -3.451714 -0.107144
H -3.735194 2.086305 -1.009296
H -2.046957 1.586756 -1.100434
H -3.269449 0.770409 -2.080334
H -3.416395 0.324252 2.251548
H -3.908947 1.817420 1.439141
H -2.196876 1.382799 1.536935
H -0.044140 -0.368201 -0.202264
H 2.582126 -1.355334 0.169287
H 2.077740 2.768146 -1.011343
H 4.073768 -0.638016 2.027956
H 3.562144 3.479712 0.859090
H 4.558151 1.776943 2.375456


%chk=000253918-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000253918

0 1
O -0.920011 -1.007295 -3.530880
O 1.743664 0.191827 -2.880150
N -2.208605 -0.954983 -0.043211
N -0.035513 -0.306533 -1.429082
C -2.248775 -2.135940 0.898208
C -3.183345 0.158742 0.271624
C -2.238076 -1.338129 -1.484659
C -1.016407 -3.045616 0.700435
C -3.570869 -2.946579 0.829130
C -2.825485 1.432074 -0.531556
C -3.213706 0.503795 1.776521
C -0.994305 -0.862362 -2.287036
C 1.244314 0.204101 -1.722800
C 1.997376 0.770572 -0.537810
C 1.466184 0.876526 0.776218
C 3.319400 1.225249 -0.783696
C 2.245587 1.424104 1.818703
C 4.097063 1.770708 0.257082
C 3.562372 1.871554 1.563624
H -2.163602 -1.710320 1.913447
H -4.211593 -0.157196 -0.031480
H -2.274666 -2.435983 -1.604367
H -3.132728 -0.948452 -2.007433
H -1.016437 -3.840680 1.467907
H -1.008829 -3.542800 -0.286402
H -0.077981 -2.471830 0.801319
H -4.451931 -2.304236 1.010117
H -3.571163 -3.743121 1.595471
H -3.698858 -3.432742 -0.155763
H -3.603607 2.199946 -0.370733
H -1.857715 1.847723 -0.195891
H -2.760022 1.251381 -1.617790
H -3.659596 -0.293384 2.395845
H -3.821150 1.414166 1.924969
H -2.193356 0.713463 2.149905
H -0.425056 -0.305051 -0.461625
H 0.447130 0.545754 1.010538
H 3.706832 1.137947 -1.804159
H 1.826424 1.503255 2.827886
H 5.116197 2.116586 0.053295
H 4.164843 2.295659 2.374580


