%chk=000270357.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270357

0 1
O -0.720539 -1.922232 -0.100181
O -3.469462 -2.643354 0.078034
O 1.013726 4.532950 0.209673
O 2.245048 -3.446583 -0.023017
O 3.390822 -2.553595 -1.622398
N -0.535888 2.974854 0.856876
N 2.727598 -2.482050 -0.600621
C -1.791205 2.627259 -1.285097
C -1.599142 3.501813 -0.032175
C -2.267143 1.243865 -0.939200
C 1.795496 2.747092 1.627558
C -1.328714 0.225857 -0.699862
C -3.632937 0.962531 -0.843931
C 0.754594 3.503976 0.806567
C 2.052768 1.382102 1.065404
C -1.759145 -1.060952 -0.361805
C -3.152137 -1.341359 -0.271693
C -4.076064 -0.326313 -0.515877
C 1.447771 0.254223 1.642195
C 2.884935 1.236195 -0.059676
C 1.660904 -1.012186 1.097835
C 3.113664 -0.024273 -0.603642
C 2.499596 -1.146428 -0.020026
C -0.998533 -3.346317 -0.049044
C -4.864237 -3.026818 0.006570
H -2.509189 3.127074 -1.968168
H -0.841459 2.580502 -1.859954
H -1.337669 4.544834 -0.336378
H -2.543453 3.553179 0.555160
H -0.697354 2.035158 1.217746
H 2.732309 3.354323 1.633150
H 1.486389 2.708182 2.693642
H -0.258645 0.413691 -0.787304
H -4.367619 1.743714 -1.027442
H -5.144266 -0.518394 -0.450788
H 0.804661 0.358159 2.515898
H 3.347679 2.116051 -0.511538
H 1.165624 -1.896538 1.517806
H 3.759216 -0.152506 -1.479939
H 0.015610 -3.767052 0.035614
H -1.612054 -3.570447 0.830148
H -1.493435 -3.671283 -0.967878
H -5.447959 -2.472004 0.746492
H -4.813846 -4.092341 0.265643
H -5.249919 -2.887757 -1.007274


%chk=000270357-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270357

0 1
O -0.537635 -1.991731 -1.025512
O -3.104739 -2.778775 -0.055815
O 0.838518 4.995194 0.625004
O 1.448876 -3.510983 1.437315
O 2.463633 -3.188577 -0.577000
N -0.303163 2.969179 0.461898
N 1.969486 -2.748957 0.534513
C -1.957949 2.731346 -1.407855
C -1.518783 3.529603 -0.148081
C -2.301460 1.279297 -1.100319
C 1.988444 2.989701 1.444887
C -1.332729 0.253867 -1.247224
C -3.585032 0.916435 -0.626625
C 0.790084 3.739640 0.795651
C 2.026351 1.489872 1.237146
C -1.608689 -1.091557 -0.917583
C -2.903019 -1.435246 -0.414741
C -3.884059 -0.422631 -0.290274
C 1.441734 0.604392 2.183399
C 2.611352 0.940338 0.062734
C 1.423402 -0.787050 1.965586
C 2.602926 -0.446354 -0.174282
C 2.000504 -1.292705 0.781922
C -0.751408 -3.282019 -1.722735
C -4.402716 -3.140780 0.519560
H -2.838910 3.247177 -1.835402
H -1.148206 2.787263 -2.158588
H -1.292607 4.578521 -0.406209
H -2.344369 3.531218 0.591633
H -0.268333 1.956687 0.611095
H 2.890398 3.475829 1.034833
H 1.958073 3.240017 2.522108
H -0.333714 0.474378 -1.640748
H -4.363051 1.681906 -0.521053
H -4.884127 -0.669935 0.078776
H 0.998621 1.011772 3.099540
H 3.072222 1.611772 -0.670767
H 0.970277 -1.479643 2.679403
H 3.038420 -0.882934 -1.076586
H 0.229393 -3.779441 -1.683206
H -1.519787 -3.882284 -1.211841
H -1.042914 -3.096742 -2.774328
H -4.599322 -2.574907 1.450610
H -4.323458 -4.213724 0.747566
H -5.226141 -2.971625 -0.201302


