%chk=000239635.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239635

0 1
O -3.096158 -0.631288 -0.944976
O -3.281905 0.990119 0.670378
N -1.606169 1.058273 -0.973003
C 2.628979 0.169966 0.473232
C 1.489414 0.774398 -0.358751
C 3.725419 -0.419545 -0.423765
C 0.393400 1.359804 0.539254
C 4.866543 -1.023061 0.407356
C -0.735929 2.027311 -0.258423
C 5.960895 -1.611715 -0.480078
C -2.698810 0.521182 -0.284556
C -4.338273 -1.257370 -0.490429
C -4.103948 -1.994680 0.811044
H 2.230035 -0.614953 1.144832
H 3.061967 0.942562 1.137792
H 1.890192 1.560758 -1.027807
H 1.063424 -0.001150 -1.023814
H 4.126118 0.363001 -1.096440
H 3.296009 -1.194578 -1.087397
H -0.023200 0.570871 1.197287
H 0.833298 2.109370 1.228107
H 4.468346 -1.808275 1.079577
H 5.299811 -0.248870 1.070558
H -1.372523 2.640142 0.425951
H -0.325430 2.723428 -1.024922
H 5.573709 -2.409867 -1.123633
H 6.770575 -2.039998 0.121486
H 6.404742 -0.851377 -1.132734
H -1.139361 0.458181 -1.654901
H -4.547027 -1.928597 -1.343885
H -5.113289 -0.475295 -0.402808
H -4.980746 -2.583561 1.103279
H -3.247275 -2.676344 0.742125
H -3.892233 -1.288343 1.629964


%chk=000239635-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239635

0 1
O -3.281133 -0.541673 -0.993047
O -3.243142 0.959325 0.835713
N -1.576946 0.952439 -0.824938
C 2.739328 0.285618 0.477136
C 1.502758 0.753527 -0.323868
C 3.777070 -0.471705 -0.381156
C 0.473706 1.509762 0.544667
C 5.012802 -0.935614 0.423894
C -0.755906 2.024800 -0.240541
C 6.047627 -1.688759 -0.439440
C -2.731099 0.507674 -0.222963
C -4.530383 -1.141940 -0.450114
C -4.216346 -2.230599 0.580614
H 2.407124 -0.366425 1.311742
H 3.225008 1.166765 0.946714
H 1.834236 1.408548 -1.157850
H 1.020166 -0.131671 -0.788289
H 4.109856 0.179334 -1.216855
H 3.294245 -1.355252 -0.849282
H 0.122289 0.857764 1.368137
H 0.966050 2.384271 1.018035
H 4.680022 -1.587479 1.257343
H 5.492956 -0.052728 0.893594
H -1.414436 2.600838 0.432395
H -0.426354 2.698907 -1.055488
H 5.601824 -2.594191 -0.893056
H 6.921207 -2.006435 0.159087
H 6.417077 -1.049184 -1.263361
H -1.278559 0.478851 -1.677561
H -5.032659 -1.550199 -1.342334
H -5.142677 -0.338187 -0.004214
H -5.152510 -2.720337 0.908522
H -3.555294 -3.002637 0.149510
H -3.727308 -1.792909 1.467154


