%chk=000179892.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179892

0 1
O -4.722061 2.226774 -0.263123
O 0.293924 -1.362541 -0.327323
O 5.873941 1.804753 0.225552
N -1.815919 2.980095 0.057668
N -4.262342 0.343545 0.994988
N -1.500717 0.757367 0.259269
N 0.979818 0.830044 0.025905
N 3.110313 -2.222842 -0.382798
N -0.475923 2.810187 -0.036793
N 3.677724 -0.077118 0.035347
N 4.459902 -2.223697 -0.324178
N 6.144575 -0.495237 0.075017
N -2.825467 -1.899791 -0.982469
N -4.100004 -3.275115 0.550980
C -5.484720 -0.422148 0.646713
C -2.446101 1.750880 0.235453
C -5.216835 -1.402519 -0.509528
C -3.920992 1.481189 0.273634
C -0.293186 1.430482 0.082013
C 2.621987 -0.930572 -0.170059
C 1.180115 -0.544402 -0.166751
C -2.438681 4.305103 -0.033085
C -3.990351 -2.258398 -0.245039
C 4.802651 -0.889720 -0.064864
C 2.361443 -3.457466 -0.642456
C 6.602795 0.846834 0.219951
H -6.305080 0.281570 0.373443
H -5.806631 -0.980504 1.558232
H -5.128026 -0.860731 -1.472666
H -6.101538 -2.069414 -0.630438
H -3.511684 -0.221372 1.413854
H 1.791559 1.472622 0.109211
H -2.373975 4.837419 0.935403
H -1.934978 4.928887 -0.797660
H -3.511758 4.197106 -0.313103
H 2.657530 -3.900180 -1.613591
H 2.558187 -4.209478 0.146360
H 1.268201 -3.246065 -0.666938
H 6.820455 -1.265811 0.042391
H -2.777220 -0.954425 -1.342813
H -1.922517 -2.161019 -0.590079
H -3.291344 -3.860049 0.734517
H 7.701830 0.875358 0.323553


%chk=000179892-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000179892

0 1
O -4.688774 2.560903 -0.043735
O 0.207759 -1.583613 -0.136190
O 5.615642 2.134972 0.023258
N -1.674901 3.001969 0.262768
N -4.212460 0.374890 0.714505
N -1.535668 0.764198 0.228371
N 0.919634 0.678410 0.046205
N 3.161194 -2.234764 -0.288631
N -0.307511 2.730887 0.165736
N 3.525864 -0.024330 -0.103161
N 4.548458 -2.093350 -0.324480
N 5.994064 -0.195029 -0.206172
N -2.904069 -2.161742 -0.270984
N -4.822129 -3.640864 -0.107383
C -5.461444 -0.301860 0.333682
C -2.389987 1.828172 0.306542
C -5.190269 -1.335290 -0.800950
C -3.877891 1.650628 0.323699
C -0.292534 1.356157 0.147968
C 2.568807 -0.997774 -0.156403
C 1.110349 -0.694180 -0.082043
C -2.148130 4.390384 0.317373
C -4.262927 -2.475354 -0.375873
C 4.703030 -0.729257 -0.207760
C 2.568494 -3.574641 -0.390230
C 6.377461 1.150497 -0.096212
H -6.173435 0.467988 -0.008264
H -5.892734 -0.817621 1.210012
H -4.779110 -0.801845 -1.679190
H -6.146541 -1.800336 -1.088728
H -3.431918 -0.233923 0.991608
H 1.783472 1.244374 0.051499
H -1.851707 4.851323 1.273987
H -1.697197 4.957860 -0.511522
H -3.243717 4.377255 0.215775
H 2.876265 -4.040286 -1.340266
H 2.921294 -4.197192 0.447853
H 1.475210 -3.467003 -0.353451
H 6.739688 -0.891012 -0.297291
H -2.490517 -1.261209 -0.531850
H -2.229105 -2.869956 0.017029
H -4.131956 -4.362421 0.196461
H 7.488847 1.233585 -0.129860


