%chk=000299429.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299429

0 1
O -5.180148 -0.974026 -0.132235
O 5.180308 -0.973863 0.132911
N -3.741946 0.602867 0.674761
N 3.742083 0.602257 -0.675553
C -1.477953 -0.362741 0.185173
C 1.478089 -0.362910 -0.185042
C -0.631642 0.900398 0.435267
C -0.632611 -1.627505 0.433868
C 0.631769 0.899998 -0.436299
C 0.632743 -1.627908 -0.432558
C -2.729281 -0.393933 1.092600
C 2.729422 -0.394946 -1.092444
C -4.917123 0.205627 0.028106
C 4.917273 0.205637 -0.028542
C -5.816370 1.332208 -0.403622
C 5.816510 1.332632 0.402124
H -1.811998 -0.365563 -0.881866
H 1.812133 -0.364745 0.882000
H -0.348866 0.960138 1.503714
H -1.226389 1.806884 0.222642
H -1.232094 -2.532053 0.213274
H -0.354992 -1.697472 1.502926
H 0.348991 0.958755 -1.504801
H 1.226509 1.806685 -0.224509
H 1.232223 -2.532253 -0.211122
H 0.355122 -1.698872 -1.501551
H -2.457222 -0.204440 2.153298
H -3.196964 -1.410434 1.057984
H 2.457363 -0.206462 -2.153323
H 3.197120 -1.411408 -1.056866
H -3.477738 1.576233 0.748092
H 3.477864 1.575552 -0.749796
H -6.737538 0.920156 -0.849069
H -6.124758 1.967940 0.435704
H -5.350898 1.970272 -1.164332
H 6.737668 0.921010 0.847987
H 6.124917 1.967554 -0.437808
H 5.351022 1.971430 1.162208


%chk=000299429-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000299429

0 1
O -4.924284 -0.641446 -0.787642
O 4.924716 -0.640661 0.787770
N -3.712465 0.546290 0.802830
N 3.712472 0.545646 -0.803444
C -1.496088 -0.516875 0.189742
C 1.496171 -0.517081 -0.189342
C -0.641101 0.751932 0.431903
C -0.643042 -1.787703 0.429123
C 0.641230 0.751546 -0.432572
C 0.643082 -1.788086 -0.427658
C -2.768484 -0.552840 1.071162
C 2.768561 -0.553802 -1.070741
C -4.735023 0.426270 -0.128424
C 4.735085 0.426566 0.127865
C -5.604908 1.674575 -0.295183
C 5.605166 1.674937 0.293100
H -1.829436 -0.519414 -0.869294
H 1.829520 -0.518740 0.869694
H -0.355995 0.797360 1.505552
H -1.237319 1.660803 0.214695
H -1.245159 -2.689929 0.203773
H -0.365142 -1.845549 1.503345
H 0.356133 0.796089 -1.506261
H 1.237476 1.660578 -0.216117
H 1.245168 -2.690145 -0.201555
H 0.365175 -1.846824 -1.501831
H -2.484150 -0.521847 2.141907
H -3.313022 -1.496384 0.884216
H 2.484209 -0.523820 -2.141511
H 3.313162 -1.497141 -0.882940
H -3.593872 1.432076 1.295837
H 3.593852 1.430933 -1.297340
H -6.438744 1.435749 -0.970948
H -6.014592 2.015235 0.673459
H -5.022131 2.506123 -0.733523
H 6.439410 1.436584 0.968530
H 6.014265 2.014853 -0.676052
H 5.022704 2.506842 0.731180


